SCHEMBL3035928

SCHEMBL3035928

Cc1nnnn1Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
P2RX7 Q99572 5/20 0.58
ALDH1A1 P00352 4/20 0.55
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.53
SLC9A1 P19634 1/20 0.49
GRM2 Q14416 1/20 0.49
TSHR P16473 3/20 0.47
MAPK1 P28482 1/20 0.47
HRH4 Q9H3N8 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
RAB9A P51151 1/20 0.47
IDO1 P14902 1/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL10053484 0.85 LMNA (0.45) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL2097553 0.81 ALDH1A1 (0.43) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL8925134 0.81 NPC1 (0.51) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL18496481 0.80 ALDH1A1 (0.53) LMNAALDH1A1KMT2AMEN1TSHR
SCHEMBL4403732 0.79 P2RX7 (0.81) LMNAP2RX7ALDH1A1KMT2A
SCHEMBL10022378 0.79 HDAC1 (0.42) LMNAP2RX7ALDH1A1TSHRHRH3
SCHEMBL19732308 0.79 ALDH1A1 (0.54) LMNAALDH1A1KMT2AMEN1TSHR
SCHEMBL4408444 0.78 LMNA (0.59) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL2163180 0.78 LMNA (0.59) LMNAP2RX7ALDH1A1KMT2AMEN1
SCHEMBL156417 0.78 ALDH1A1 (0.66) LMNAP2RX7ALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365544-A1 SMALL MOLECULE INHIBITORS OF CALCIUM CHANNEL ACTIVITY AND USES THEREOF NATIONAL INSTITUTES OF HEALTH 2023-11-16 US disclosed
US-20230365544-A1 SMALL MOLECULE INHIBITORS OF CALCIUM CHANNEL ACTIVITY AND USES THEREOF NATIONAL INSTITUTES OF HEALTH 2023-11-16 US disclosed
WO-2021231553-A1 SMALL MOLECULE INHIBITORS OF CAV3.2 ACTIVITY AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2021-11-18 WO disclosed
WO-2020123670-A1 SMALL MOLECULE INHIBITORS OF THE ANDROGEN RECEPTOR ACTIVITY AND/OR EXPRESSION AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2020-06-18 WO disclosed
EP-3210609-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. (US) 2017-08-30 EP disclosed
US-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. 2017-08-03 US disclosed
US-9273077-B2 Phosphorus derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2016-03-01 US disclosed
US-20150225436-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. (US) 2015-08-13 US disclosed
US-9012462-B2 Phosphorous derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2015-04-21 US disclosed
US-8912330-B2 Azaindole derivatives as kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2014-12-16 US disclosed
US-20080176911-A1 ACYLAMINOTHIAZOLE DERIVATIVES AND USE THEREOF AS BETA-AMYLOID INHIBITORS SANOFI-AVENTIS (FR) 2008-07-24 US disclosed
US-7371770-B2 Acylaminothiazole derivatives and use thereof as β-amyloid inhibitors SANOFIAVENTIS (FR) 2008-05-13 US disclosed
US-7371770-B2 Acylaminothiazole derivatives and use thereof as β-amyloid inhibitors SANOFIAVENTIS (FR) 2008-05-13 US disclosed
EP-1859782-A1 Composition for coloring and/or lightening human hair comprising tetrazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US disclosed
US-20070270422-A1 Aromatic Compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-11-22 US disclosed
WO-2007125398-A2 : SULFONAMIDE COMPOUNDS AS ANTAGONISTS OF THE N-TYPE CALCIUM CHANNEL PFIZER JAPAN INC. (JP) 2007-11-08 WO disclosed
WO-2007066784-A2 DIARYLETHER DERIVATIVES AS ANTITUMOR AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-06-14 WO disclosed
US-4632674-A Diesel fuel containing a tetrazole or triazole cetane improver EXXON CHEMICAL PATENTS INC. (US) 1986-12-30 US 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 (5 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-20170218000-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 LMNA 4121/4885P2RX7 1585/4885ALDH1A1 4677/4885
US-20230365544-A1 SMALL MOLECULE INHIBITORS OF CALCIUM CHANNEL ACTIVITY AND USES THEREOF CACNA1G, CACNA1I, CACNG3 LMNA 1895/4885P2RX7 184/4885ALDH1A1 3418/4885
US-20150225436-A1 PHOSPHOROUS DERIVATIVES AS KINASE INHIBITORS MAP3K6, PIK3CA, MAP3K20 LMNA 4289/4885P2RX7 1388/4885ALDH1A1 4769/4885
US-20080176911-A1 ACYLAMINOTHIAZOLE DERIVATIVES AND USE THEREOF AS BETA-AMYLOID INHIBITORS APP, BACE1, ATG4A LMNA 1762/4885P2RX7 4192/4885ALDH1A1 4081/4885
US-20070270422-A1 Aromatic Compounds COL1A1, COL2A1, COL14A1 LMNA 1091/4885P2RX7 1100/4885ALDH1A1 475/4885

“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.