SCHEMBL897466

SCHEMBL897466

[CH2]c1ccccc1NCCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
MAPT P10636 3/20 0.48
GAA P10253 3/20 0.48
RAB9A P51151 4/20 0.47
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TAAR1 Q96RJ0 2/20 0.47
LMNA P02545 2/20 0.47
NPC1 O15118 2/20 0.47
ATM Q13315 1/20 0.47
KDM1A O60341 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
CYP2C8 P10632 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
IDO1 P14902 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL5538885 0.79 HSD17B10 (0.59) L3MBTL1MAPTALDH1A1IDO1TSHR
SCHEMBL7443912 0.76 L3MBTL1 (0.53) L3MBTL1MAPTGAARAB9AALDH1A1
SCHEMBL3047149 0.76 L3MBTL1 (0.53) L3MBTL1MAPTGAARAB9AALDH1A1
SCHEMBL8557281 0.76 L3MBTL1 (0.53) L3MBTL1MAPTGAARAB9AALDH1A1
SCHEMBL6542650 0.76 MAPT (0.69) L3MBTL1MAPTGAARAB9AALDH1A1
SCHEMBL3910980 0.76 L3MBTL1 (0.59) L3MBTL1MAPTGAARAB9AALDH1A1
SCHEMBL4756063 0.76 L3MBTL1 (0.53) L3MBTL1MAPTGAARAB9AALDH1A1
SCHEMBL3907119 0.76 L3MBTL1 (0.53) L3MBTL1MAPTRAB9AALDH1A1SMN1; SMN2
SCHEMBL6032214 0.76 L3MBTL1 (0.53) L3MBTL1MAPTGAARAB9AALDH1A1
SCHEMBL7357539 0.75 IDO1 (0.47) MAPTADRA2AIDO1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018017221-A1 METHOD TO EXTRACT BITUMEN FROM OIL SANDS USING AROMATIC AMINES DOW GLOBAL TECHNOLOGIES LLC (US) 2018-01-25 WO claimed
US-8828438-B2 Pharmaceutical compositions of cholesteryl ester transfer protein inhibitors and HMG-CoA reductase BEND RESEARCH, INC. (US) 2014-09-09 US disclosed
EP-2464647-A1 AZAINDAZOLES AS BTK KINASE MODULATORS AND USE THEREOF Bristol-Myers Squibb Company (US) 2012-06-20 EP disclosed
US-20120083490-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2012-04-05 US disclosed
WO-2011019780-A1 AZAINDAZOLES AS BTK KINASE MODULATORS AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY (US) 2011-02-17 WO disclosed
EP-2081917-A2 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF Abbott Laboratories (US) 2009-07-29 EP disclosed
EP-2062054-A1 USE OF LIPOCALIN 2 IN THE REGULATION OF INSULIN SENSITIVITY Beth Israel Deaconess Medical Center, Inc. (US) 2009-05-27 EP disclosed
US-20090118328-A1 Pharmaceutical Compositions Of Cholesteryl Ester Transfer Protein Inhibitors And Hmg-Coa Reductase BEND RESEARCH, INC. (US) 2009-05-07 US disclosed
EP-1846005-A4 KITS AND IMPROVED COMPOSITIONS FOR TREATING LOWER URINARY TRACT URIGEN INC (US) 2008-12-10 EP disclosed
WO-2008030370-A9 USE OF LIPOCALIN 2 IN THE REGULATION OF INSULIN SENSITIVITY BETH ISRAEL HOSPITAL (US) 2008-05-22 WO disclosed
EP-0600831-A1 Phtalazinon derivatives CIBA-GEIGY AG (CH) 1994-06-08 EP disclosed
EP-0600832-A1 Derivatives of diamino benzoic and diamino phthalic acid und their use as protein linase inhibitors CIBA-GEIGY AG (CH) 1994-06-08 EP disclosed
US-5246952-A Antitumor agents CIBA-GEIGY CORPORATION (US) 1993-09-21 US disclosed
US-5227393-A estrogen-dependent diseases, anticancer CIBA-GEIGY CORPORATION (US) 1993-07-13 US disclosed
EP-0516588-A1 Substituted diaminophtalimides and analogues CIBA-GEIGY AG (CH) 1992-12-02 EP disclosed
EP-0477141-A1 Heteroarylmethylbenzols aromatase inhibitors CIBA-GEIGY AG (CH) 1992-03-25 EP disclosed
US-5073574-A TETRAZOLYL SUBSTITUTED BENZONITRILES AND ANTI-TUMOR USE THEREOF CIBA-GEIGY CORPORATION (US) 1991-12-17 US disclosed
EP-0457716-A1 Naphthalin derivatives CIBA-GEIGY AG (CH) 1991-11-21 EP disclosed
EP-0445073-A1 Benzofurans CIBA-GEIGY AG (CH) 1991-09-04 EP disclosed
EP-0408509-A2 Substituted benzonitriles CIBA-GEIGY AG (CH) 1991-01-16 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 (2 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-20120083490-A1 CYTOCHROME P450 OXIDASE INHIBITORS AND USES THEREOF CYP3A43, CYP3A5, POR L3MBTL1 4679/4885MAPT 2964/4885GAA 408/4885
US-20090118328-A1 Pharmaceutical Compositions Of Cholesteryl Ester Transfer Protein Inhibitors And Hmg-Coa Reductase CETP, HMGCR, MTTP L3MBTL1 4128/4885MAPT 547/4885GAA 301/4885

“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.