SCHEMBL7248285

SCHEMBL7248285

COc1ccc(C(=O)c2cccc(N)c2NC(=O)c2ccc(-c3ccncc3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
RAB9A P51151 2/20 0.51
MEN1 O00255 1/20 0.51
NPC1 O15118 1/20 0.51
POLB P06746 1/20 0.51
CYP2C9 P11712 4/20 0.50
HDAC1 Q13547 4/20 0.50
CYP3A4 P08684 3/20 0.50
CYP2D6 P10635 3/20 0.50
HDAC2 Q92769 3/20 0.50
HDAC3 O15379 2/20 0.50
HDAC4 P56524 2/20 0.50
HDAC7 Q8WUI4 2/20 0.50
HDAC10 Q969S8 2/20 0.50
HDAC11 Q96DB2 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
HDAC9 Q9UKV0 2/20 0.50
HDAC5 Q9UQL6 2/20 0.50
CYP1A2 P05177 1/20 0.50

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
SCHEMBL5226656 0.91 KMT2A (0.48) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL5224939 0.90 HDAC2 (0.56) KMT2ARAB9ANPC1POLBHDAC1
SCHEMBL7246022 0.85 HDAC1 (0.59) KMT2ARAB9AMEN1NPC1CYP2C9
SCHEMBL7251479 0.85 ALDH1A1 (0.44) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL5222203 0.83 MAPT (0.54) KMT2ARAB9AMEN1NPC1CYP2C9
SCHEMBL6255143 0.83 CYP3A4 (0.50) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL7246319 0.82 HDAC1 (0.52) KMT2ARAB9ANPC1CYP2C9HDAC1
SCHEMBL7245730 0.82 HDAC1 (0.52) KMT2ARAB9AMEN1NPC1CYP2C9
Hydrochloric Acid SCHEMBL6778471 0.82 HDAC1 (0.52) KMT2ARAB9ANPC1CYP2C9HDAC1
SCHEMBL5224278 0.82 NPC1 (0.58) KMT2ARAB9AMEN1NPC1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605626-B2 Benzamide inhibitors of factor Xa ELI LILLY AND COMPANY 2003-08-12 US disclosed
US-20020120007-A1 Benzamide inhibitors of factor Xa BEIGHT DOUGLAS WADE (US) 2002-08-29 US disclosed
US-6313122-B1 AS INHIBITORS OF FACTOR XA AND ARE USED AS ANTICOAGULANTS IN MAMMALS ELI LILLY AND COMPANY 2001-11-06 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 (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-20020120007-A1 Benzamide inhibitors of factor Xa TFPI, F11, F12 KMT2A 2083/4885RAB9A 2658/4885MEN1 1119/4885

“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.