SCHEMBL15935401

SCHEMBL15935401

Cc1ccn(-c2ccc(C#N)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.51
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
LMNA P02545 1/20 0.43
CYP2A6 P11509 1/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
ATM Q13315 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
EP300 Q09472 3/20 0.42
KDM4E B2RXH2 2/20 0.42
GAA P10253 1/20 0.42
NOTUM Q6P988 1/20 0.41
MAPKAPK2 P49137 1/20 0.40
HDAC4 P56524 1/20 0.40
OPRM1 P35372 1/20 0.39
CACNA2D1 P54289 1/20 0.39
CYP19A1 P11511 2/20 0.38
CYP11B1 P15538 1/20 0.38

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
SCHEMBL7237232 0.80 GRM5 (0.58) HTTALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL12422701 0.78 HTT (0.59) HTTALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL15352616 0.78 ALDH1A1 (0.47) HTTALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL15824279 0.78 ALDH1A1 (0.43) ALDH1A1MAPTSMN1; SMN2LMNACYP2A6
SCHEMBL2584832 0.78 ALDH1A1 (0.43) ALDH1A1MAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL23176209 0.77 NOTUM (0.45) ALDH1A1MAPTSMN1; SMN2LMNACYP2A6
SCHEMBL17356163 0.77 ALDH1A1 (0.41) ALDH1A1MAPTSMN1; SMN2LMNACYP2A6
SCHEMBL18865695 0.77 MAPKAPK2 (0.47) ALDH1A1MAPTSMN1; SMN2LMNACYP2A6
SCHEMBL5149995 0.77 ALDH1A1 (0.44) HTTALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL28734542 0.77 ALDH1A1 (0.48) HTTALDH1A1MAPTSMN1; SMN2LMNA

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024117179-A1 KIT INHIBITORS, COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF ALIVEXIS, INC. (JP) 2024-06-06 WO disclosed
WO-2024117179-A1 KIT INHIBITORS, COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF ALIVEXIS, INC. (JP) 2024-06-06 WO disclosed
EP-2934538-B1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME (US) 2021-03-31 EP disclosed
EP-2934536-B1 FACTOR IXa INHIBITORS MERCK SHARP & DOHME (US) 2017-09-27 EP disclosed
US-9708308-B2 Factor IXa inhibitors MERCK SHARP DOHME CORP. (US) 2017-07-18 US disclosed
US-9695198-B2 Factor IXa inhibitors MERCK SHARP & DOHME CORP. (US) 2017-07-04 US disclosed
US-9271501-B2 Use of strobilurin type compounds for combating phytopathogenic fungi resistant to QO inhibitors BASF SE (DE) 2016-03-01 US disclosed
US-20150368269-A1 Factor IXa Inhibitors MERCK SHARP & DOHME CORP. (US) 2015-12-24 US disclosed
US-20150322056-A1 Factor IXa Inhibitors MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-11-12 US disclosed
US-20140323305-A1 Use of Strobilurin Type Compounds for Combating Phytopathogenic Fungi Resistant to QO Inhibitors BASF SE (DE) 2014-10-30 US disclosed
WO-2014120346-A1 FACTOR IXA INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 WO 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 (3 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-20150322056-A1 Factor IXa Inhibitors F9, F12, F8 HTT 1935/4885ALDH1A1 3931/4885MAPT 4751/4885
US-20140323305-A1 Use of Strobilurin Type Compounds for Combating Phytopathogenic Fungi Resistant to QO Inhibitors SQOR, COX5B, UQCRB HTT 2375/4885ALDH1A1 2278/4885MAPT 2644/4885
US-20150368269-A1 Factor IXa Inhibitors F9, TFPI, F13B HTT 2667/4885ALDH1A1 1321/4885MAPT 4555/4885

“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.