SCHEMBL6492271

SCHEMBL6492271

COc1ccc(-c2ccc(C)cc2)c(C(=O)O)c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.84
KDM4E B2RXH2 4/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2D6 P10635 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
AKR1C3 P42330 3/20 0.55
AKR1C2 P52895 3/20 0.55
POLB P06746 3/20 0.53
HSD17B10 Q99714 2/20 0.53
CYP2C8 P10632 1/20 0.51
PTPN11 Q06124 2/20 0.49
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
CASP3 P42574 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48

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
SCHEMBL26768653 0.92 SMN1; SMN2 (1.00) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL8566031 0.87 SMN1; SMN2 (0.64) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL5342329 0.87 SMN1; SMN2 (0.84) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL6490238 0.86 SMN1; SMN2 (0.82) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL3816798 0.86 SMN1; SMN2 (0.82) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL6492074 0.84 ALDH1A1 (0.61) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL2559289 0.84 SMN1; SMN2 (0.79) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL5155116 0.84 SMN1; SMN2 (0.79) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL29853676 0.84 SMN1; SMN2 (0.79) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL7267474 0.84 SMN1; SMN2 (0.79) SMN1; SMN2KDM4ECYP1A2CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 US disclosed
EP-0598702-B1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same EISAI CO LTD (JP) 1998-06-10 EP disclosed
EP-0628557-B1 Biphenylmethane derivatives, the use of them and pharmacological compositions containing same EISAI CO LTD (JP) 1997-05-02 EP disclosed
US-5506238-A HYPOTENSIVE AGENT EISAI CO., LTD. (JP) 1996-04-09 US disclosed
EP-0420237-B1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same EISAI CO LTD (JP) 1996-03-06 EP disclosed
EP-0628557-A1 Biphenylmethane derivatives, the use of them and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-12-14 EP disclosed
US-5328911-A Cardiovascular disorders, hypotensive agents and congestive heart failure EISAI CO., LTD. (JP) 1994-07-12 US disclosed
EP-0598702-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1994-05-25 EP disclosed
US-5298518-A Biphenylmethane derivative and pharmacological use EISAI CO., LTD. (JP) 1994-03-29 US disclosed
EP-0420237-A1 Biphenylmethane derivative, the use of it and pharmacological compositions containing same Eisai Co., Ltd. (JP) 1991-04-03 EP 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 SMN1; SMN2 1921/4885KDM4E 2286/4885CYP1A2 115/4885

“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.