SCHEMBL6926264

SCHEMBL6926264

Cc1ccc(C(=O)Nc2ccc(C(=O)CCC(=O)O)cc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.72
NPC1 O15118 6/20 0.69
RAB9A P51151 6/20 0.69
MAPT P10636 3/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
MEN1 O00255 4/20 0.58
POLB P06746 3/20 0.58
ATM Q13315 1/20 0.57
LMNA P02545 4/20 0.56
NR1H4 Q96RI1 2/20 0.52
P4HTM Q9NXG6 2/20 0.51
KDM4E B2RXH2 2/20 0.51
NAMPT P43490 2/20 0.51
MCL1 Q07820 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 1/20 0.50
CCR5 P51681 1/20 0.50
USP2 O75604 1/20 0.49

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
SCHEMBL6930410 0.89 KMT2A (0.74) KMT2ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL6927758 0.87 NR4A2 (0.67) KMT2ANPC1RAB9AMAPTSMN1; SMN2
SCHEMBL6929993 0.85 KMT2A (0.62) KMT2ANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL6926215 0.85 NR1H4 (0.72) KMT2ANPC1RAB9AMAPTSMN1; SMN2
Succinic Acid SCHEMBL8467793 0.85 KMT2A (1.00) KMT2ANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL16922187 0.85 KMT2A (1.00) KMT2ANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL822930 0.85 KMT2A (1.00) KMT2ANPC1RAB9ASMN1; SMN2MEN1
SCHEMBL6925547 0.84 KMT2A (0.60) KMT2AMAPTMEN1POLBLMNA
SCHEMBL6925985 0.84 MITF (0.66) KMT2ANPC1RAB9AMEN1POLB
SCHEMBL6925253 0.84 TP53 (0.58) KMT2ANPC1RAB9ASMN1; SMN2MEN1

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-6624196-B2 Particularly gelatinase A, collagenase-3, and stromelysin-1 and for the treatment of multiple sclerosis, cardiovascular disorders WARNER-LAMBERT COMPANY 2003-09-23 US claimed
US-6541521-B1 Particularly gelatinase A, collagenase-3, and stromelysin-1 WARNER-LAMBERT COMPANY 2003-04-01 US claimed
US-20020161050-A1 Benzene butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY (US) 2002-10-31 US claimed
US-6624196-B2 Particularly gelatinase A, collagenase-3, and stromelysin-1 and for the treatment of multiple sclerosis, cardiovascular disorders WARNER-LAMBERT COMPANY 2003-09-23 US disclosed
US-6541521-B1 Particularly gelatinase A, collagenase-3, and stromelysin-1 WARNER-LAMBERT COMPANY 2003-04-01 US disclosed
US-20020161050-A1 Benzene butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY (US) 2002-10-31 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-20020161050-A1 Benzene butyric acids and their derivatives as inhibitors of matrix metalloproteinases MMP1, MMP8, MMP13 KMT2A 4700/4885NPC1 2628/4885RAB9A 2177/4885

“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.