SCHEMBL2397649

SCHEMBL2397649

CC(C)(C)CCCNCCCC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TSHR P16473 3/20 0.40
ALDH1A1 P00352 2/20 0.40
GLA P06280 1/20 0.40
CYP1A2 P05177 3/20 0.38
CA12 O43570 5/20 0.35
CA6 P23280 5/20 0.35
CA7 P43166 5/20 0.35
CA9 Q16790 5/20 0.35
CA14 Q9ULX7 5/20 0.35
CA5B Q9Y2D0 5/20 0.35
CA2 P00918 4/20 0.35
CA4 P22748 4/20 0.35
CA5A P35218 4/20 0.35
CA3 P07451 3/20 0.35
ALOX15 P16050 3/20 0.33
CASP2 P42575 2/20 0.33
F13A1 P00488 2/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19504379 0.97 CYP2C19 (0.38) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL13649902 0.94 CYP2C19 (0.36) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL2398897 0.90 TSHR (0.45) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL12011756 0.89 TSHR (0.46) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL13304783 0.89 CA12 (0.55) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL19749942 0.89 TSHR (0.52) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL2399973 0.88 TSHR (0.43) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL2398482 0.88 TSHR (0.43) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL24086476 0.87 ALDH1A1 (0.38) CYP2C19MEN1KMT2ATSHRALDH1A1
SCHEMBL17831473 0.87 TSHR (0.50) CYP2C19MEN1KMT2ATSHRALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11325111-B2 Catalysts and methods of making the same EXXONMOBIL RESEARCH & ENGINEERING COMPANY (US) 2022-05-10 US disclosed
US-11111352-B2 Methods of producing organosilica materials and uses thereof EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2021-09-07 US disclosed
EP-3230325-B1 METHODS OF SEPARATING AROMATIC COMPOUNDS FROM LUBE BASE STOCKES EXXONMOBIL RES & ENG CO (US) 2020-06-17 EP disclosed
US-10661262-B2 Aromatic hydrogenation catalysts and uses thereof EXXONMOBIL RESEARCH & ENGINEERING COMPANY (US) 2020-05-26 US disclosed
US-10576453-B2 Membrane fabrication methods using organosilica materials and uses thereof EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2020-03-03 US disclosed
US-10544239-B2 Organosilica materials and uses thereof EXXONMOBILE RESEARCH AND ENGINEERING COMPANY (US) 2020-01-28 US disclosed
US-10435514-B2 Organosilica materials, methods of making, and uses thereof EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2019-10-08 US disclosed
US-10351639-B2 Organosilica materials for use as adsorbents for oxygenate removal EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2019-07-16 US disclosed
EP-3229953-B1 COATING METHOD USING ORGANOSILICA MATERIAL, COATED SUBSTRATE, AND GAS SEPARATION PROCESS EMPLOYING SAID SUBSTRATE EXXONMOBIL RES & ENG CO (US) 2019-07-03 EP disclosed
US-20190194414-A1 METHODS OF PRODUCING ORGANOSILICA MATERIALS AND USES THEREOF EXXONMOBIL RES & ENG CO (US) 2019-06-27 US disclosed
US-20170320977-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM COMPRISING MESOPOROUS ORGANOSILICA SUPPORT EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2017-11-09 US disclosed
US-20170320971-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM COMPRISING MESOPOROUS ORGANOSILICA SUPPORT EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2017-11-09 US disclosed
US-20170306068-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM COMPRISING MESOPOROUS ORGANOSILICA SUPPORT EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2017-10-26 US disclosed
US-8957212-B2 Photobase generator WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2015-02-17 US disclosed
EP-2368875-B1 PHOTOBASE GENERATOR WAKO PURE CHEM IND LTD (JP) 2014-09-03 EP disclosed
US-20110233048-A1 PHOTOBASE GENERATOR WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2011-09-29 US disclosed
EP-2368875-A1 PHOTOBASE GENERATOR Wako Pure Chemical Industries, Ltd. (JP) 2011-09-28 EP disclosed
US-7250514-B1 Histone deacetylase inhibitors TAKEDA SAN DIEGO, INC. (US) 2007-07-31 US disclosed
US-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus MITSUI CHEMICALS, INC. (JP) 2006-04-27 US disclosed
EP-1484191-A1 REWRITABLE OPTICAL INFORMATION RECORDING MEDIUM AND RECORDING/REPRODUCING METHOD, RECORDING/REPRODUCING DEVICE Sony Corporation (JP) 2004-12-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10661262-B2 Aromatic hydrogenation catalysts and uses thereof H1-0, H1-2, H1-3 CYP2C19 1571/4885MEN1 364/4885KMT2A 274/4885
US-20060088786-A1 Rewritable optical information recording medium, recording and reproducing methods, as well as recording and reproducing apparatus ALPG, TRPC6, GNRHR CYP2C19 2583/4885MEN1 1357/4885KMT2A 606/4885
US-11325111-B2 Catalysts and methods of making the same CAT, STOM, SOD1 CYP2C19 3414/4885MEN1 723/4885KMT2A 223/4885
US-20170320971-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM COMPRISING MESOPOROUS ORGANOSILICA SUPPORT SCO2, HAO2, ZYX CYP2C19 181/4885MEN1 656/4885KMT2A 842/4885
US-20110233048-A1 PHOTOBASE GENERATOR CYBA, CRY1, GNB1 CYP2C19 588/4885MEN1 1987/4885KMT2A 2516/4885
US-10576453-B2 Membrane fabrication methods using organosilica materials and uses thereof ZYX, GPX4, PLA2G2A CYP2C19 1034/4885MEN1 1030/4885KMT2A 459/4885
US-10544239-B2 Organosilica materials and uses thereof ZC3HAV1L, ZYX, ZC3HAV1 CYP2C19 2957/4885MEN1 13/4885KMT2A 275/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.