SCHEMBL6929488

SCHEMBL6929488

O=C(O)c1cc(Cl)ccc1-n1cncn1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.51
NR4A1 P22736 1/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
APOBEC3A P31941 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
ALDH1A1 P00352 2/20 0.47
CRHBP P24387 1/20 0.46
CRHR2 Q13324 1/20 0.46
RAB9A P51151 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
TP53 P04637 1/20 0.46
HSP90AA1 P07900 1/20 0.46
ATM Q13315 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
SCHEMBL15562064 0.83 KMT2A (0.49) KMT2AMEN1APOBEC3AAPOBEC3GALDH1A1
SCHEMBL28323928 0.82 CYP1A2 (0.43) KMT2AMEN1ALDH1A1
SCHEMBL31133353 0.82 CYP1A2 (0.49) KMT2AMEN1ALDH1A1RAB9ARXFP1
SCHEMBL21816086 0.82 CYP1A2 (0.49) KMT2AMEN1ALDH1A1RAB9ARXFP1
SCHEMBL31175307 0.82 CYP3A4 (0.46) MYCKMT2AMEN1APOBEC3AAPOBEC3G
SCHEMBL15175702 0.82 CYP3A4 (0.46) MYCKMT2AMEN1APOBEC3AAPOBEC3G
SCHEMBL29099977 0.82 MYC (0.51) MYCNR4A1KMT2AMEN1ALDH1A1
SCHEMBL29510565 0.80 CYP1A2 (0.42) KMT2AMEN1ALDH1A1
SCHEMBL21815977 0.78 ALDH1A1 (0.57) ALDH1A1
SCHEMBL21816405 0.78 CYP1A2 (0.49) KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030225131-A1 Thrombin inhibitors BURGEY CHRISTOPHER S (US) 2003-12-04 US disclosed
WO-2002022584-A1 THROMBIN INHIBITORS MERCK & CO., INC. (US) 2002-03-21 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 (1 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-20030225131-A1 Thrombin inhibitors TFPI, SERPINC1, PLAT MYC 4864/4885NR4A1 4770/4885KMT2A 3473/4885

“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.