SCHEMBL2884910

SCHEMBL2884910

O=Cc1ccc2ncnc(NCc3ccccc3)c2c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 9/20 0.67
HTT P42858 3/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
ERBB2 P04626 1/20 0.66
EGFR P00533 8/20 0.66
GALR3 O60755 2/20 0.63
NR2F2 P24468 2/20 0.63
RAB9A P51151 1/20 0.63
MAPK1 P28482 8/20 0.62
TSHR P16473 7/20 0.62
ALDH1A1 P00352 8/20 0.57
CYP1A2 P05177 8/20 0.57
CYP3A4 P08684 8/20 0.57
CYP2D6 P10635 8/20 0.57
HSD17B10 Q99714 8/20 0.57
USP2 O75604 7/20 0.57
CLK4 Q9HAZ1 7/20 0.57
CYP2C19 P33261 6/20 0.57
CYP2C9 P11712 6/20 0.57
HIF1A Q16665 5/20 0.57

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
SCHEMBL2880436 0.87 HTT (0.71) LMNAHTTSMN1; SMN2MAPK1TSHR
SCHEMBL2884882 0.84 ALDH1A1 (0.58) LMNAHTTSMN1; SMN2ERBB2EGFR
SCHEMBL17845927 0.81 LMNA (1.00) LMNAHTTSMN1; SMN2EGFRGALR3
SCHEMBL2880273 0.80 MAOB (0.61) LMNAHTTSMN1; SMN2ERBB2EGFR
SCHEMBL2880271 0.80 MAOB (0.61) LMNAHTTSMN1; SMN2ERBB2EGFR
SCHEMBL1734678 0.80 LMNA (0.72) LMNAHTTSMN1; SMN2EGFRGALR3
SCHEMBL9921364 0.80 LMNA (0.72) LMNAHTTSMN1; SMN2EGFRGALR3
SCHEMBL9973593 0.80 EGFR (0.65) LMNAHTTERBB2EGFRMAPK1
SCHEMBL7612718 0.78 EGFR (1.00) LMNAHTTSMN1; SMN2EGFRGALR3
SCHEMBL29386010 0.78 EGFR (1.00) LMNAHTTSMN1; SMN2EGFRGALR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
CN-1681811-B Azolidinone-vinyl fused-benzene derivatives APPLIED RESEARCH SYSTEMS 2010-05-26 CN disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2006-06-08 US disclosed
CN-1681811-A Azolidinone-vinyl fused-benzene derivatives APPLIED RESEARCH SYSTEMS (AN) 2005-10-12 CN disclosed
US-20050222225-A1 Use of compounds for increasing spermatozoa motility APPLIED RESEARCH SYSTEMS ARS HOLDING NV (NL) 2005-10-06 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 (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-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES ZAP70, BRCA1, ZYX LMNA 3252/4885HTT 1649/4885SMN1; SMN2 2134/4885
US-20050222225-A1 Use of compounds for increasing spermatozoa motility CATSPER1, PI4KB, MAN2B2 LMNA 1094/4885HTT 3887/4885SMN1; SMN2 3624/4885
US-20060122176-A1 Azolidinone-vinyl fused-benzene derivatives BRCA1, ZAP70, F13B LMNA 3373/4885HTT 1583/4885SMN1; SMN2 2104/4885

“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.