SCHEMBL7864409

SCHEMBL7864409

CC(C)(C)c1ccc(-c2ccc(C(=O)CCC(=O)O)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
LMNA P02545 2/20 0.66
FFAR1 O14842 1/20 0.66
CYP1A2 P05177 1/20 0.66
HIF1A Q16665 1/20 0.66
KMT2A Q03164 1/20 0.58
NR4A2 P43354 1/20 0.53
NPC1 O15118 2/20 0.53
USP5 P45974 1/20 0.53
MAPT P10636 1/20 0.53
L3MBTL1 Q9Y468 2/20 0.51
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
RXRG P48443 2/20 0.50
HPGD P15428 1/20 0.50
NR1H4 Q96RI1 5/20 0.49
ALDH1A1 P00352 3/20 0.49
RECQL P46063 2/20 0.49
EPHX2 P34913 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
SCHEMBL2051247 0.95 KMT2A (0.63) RAB9ASMN1; SMN2LMNAFFAR1CYP1A2
SCHEMBL7079689 0.87 RAB9A (0.66) RAB9ASMN1; SMN2LMNAHIF1AKMT2A
SCHEMBL10884944 0.85 SMN1; SMN2 (0.88) RAB9ASMN1; SMN2LMNAFFAR1CYP1A2
SCHEMBL6926215 0.83 NR1H4 (0.72) RAB9ASMN1; SMN2LMNAKMT2ANPC1
SCHEMBL7857488 0.83 SMN1; SMN2 (0.66) RAB9ASMN1; SMN2LMNAFFAR1CYP1A2
SCHEMBL7868125 0.82 LMNA (0.56) RAB9ASMN1; SMN2LMNAFFAR1CYP1A2
SCHEMBL7865400 0.81 LMNA (0.50) RAB9ASMN1; SMN2LMNAFFAR1CYP1A2
SCHEMBL7865399 0.81 LMNA (0.50) RAB9ASMN1; SMN2LMNAFFAR1CYP1A2
SCHEMBL7857467 0.80 KMT2A (0.89) RAB9ASMN1; SMN2LMNAFFAR1CYP1A2
SCHEMBL3628612 0.80 RAB9A (0.58) RAB9ASMN1; SMN2LMNAHIF1AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6307089-B2 Biphenyl butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY 2001-10-23 US disclosed
US-6239288-B1 RHEUMATIC DISEASES WARNER-LAMBERT COMPANY 2001-05-29 US disclosed
US-20010000513-A1 Biphenyl butyric acids and their derivatives as inhibitors of matrix metalloproteinases WARNER-LAMBERT COMPANY 2001-04-26 US disclosed
EP-0927156-A1 BIPHENYL BUTYRIC ACIDS AND THEIR DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES WARNER-LAMBERT COMPANY (US) 1999-07-07 EP disclosed
WO-1998009940-A1 BIPHENYL BUTYRIC ACIDS AND THEIR DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES WARNER-LAMBERT COMPANY (US) 1998-03-12 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-20010000513-A1 Biphenyl butyric acids and their derivatives as inhibitors of matrix metalloproteinases MMP26, MMP1, MMP9 RAB9A 3049/4885SMN1; SMN2 1912/4885LMNA 1839/4885

“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.