SCHEMBL3680963

SCHEMBL3680963

CCC(O)CNCc1ccc(OC)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.59
ANPEP P15144 1/20 0.56
ERAP2 Q6P179 1/20 0.56
TSHR P16473 1/20 0.55
ROCK2 O75116 1/20 0.53
NPC1 O15118 1/20 0.52
ADRB3 P13945 3/20 0.52
CHRM2 P08172 1/20 0.51
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
DPP7 Q9UHL4 2/20 0.50
ALDH1A1 P00352 1/20 0.49
PKM P14618 1/20 0.49
MITF O75030 1/20 0.48
LMNA P02545 1/20 0.48
CNR1 P21554 1/20 0.48
CNR2 P34972 1/20 0.48
GPR35 Q9HC97 1/20 0.48
GPR55 Q9Y2T6 1/20 0.48
XBP1 P17861 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
SCHEMBL26618636 1.00 DNM1 (0.59) DNM1ANPEPERAP2TSHRROCK2
SCHEMBL2916825 0.85 DNM1 (0.58) DNM1ANPEPERAP2TSHRNPC1
SCHEMBL15819968 0.83 ANPEP (0.59) DNM1ANPEPERAP2TSHRADRB3
SCHEMBL6499108 0.83 ANPEP (0.59) DNM1ANPEPERAP2TSHRADRB3
SCHEMBL6492794 0.83 ANPEP (0.59) DNM1ANPEPERAP2TSHRADRB3
SCHEMBL25121044 0.82 S1PR2 (0.52) DNM1ANPEPERAP2TSHRADRB3
SCHEMBL6640768 0.81 CHRM2 (0.62) DNM1ADRB3CHRM2KMT2AMEN1
SCHEMBL898462 0.81 ANPEP (0.66) DNM1ANPEPERAP2TSHRADRB3
SCHEMBL3709824 0.81 ANPEP (0.56) DNM1ANPEPERAP2CHRM2DPP7
SCHEMBL16700680 0.81 GAA (0.65) DNM1ANPEPERAP2TSHRCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250296939-A1 BENZOTHIOPHENE COMPOUND KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2025-09-25 US disclosed
EP-4516792-A1 BENZOTHIOPHENE COMPOUND Kyoto Pharmaceutical Industries, Ltd. (JP) 2025-03-05 EP disclosed
WO-2023210740-A1 BENZOTHIOPHENE COMPOUND 第一三共株式会社 2023-11-02 WO disclosed
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
US-7655641-B2 Sulfonamide derivatives as PPAR modulators ELI LILLY AND COMPANY (US) 2010-02-02 US disclosed
US-7402595-B2 Enzyme inhibitors with isoquinolinone structures TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-22 US disclosed
EP-1597248-B1 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS LILLY CO ELI (US) 2007-12-26 EP disclosed
EP-1597248-B1 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS LILLY CO ELI (US) 2007-12-26 EP disclosed
US-20060217433-A1 Sulfonamide derivatives as ppar modulators ELI LILLY AND COMPANY (US) 2006-09-28 US disclosed
EP-1597248-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-11-23 EP disclosed
US-20050148624-A1 Jnk inhibitor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-07-07 US disclosed
EP-1484320-A1 JNK INHIBITOR Takeda Chemical Industries, Ltd. (JP) 2004-12-08 EP disclosed
WO-2004073606-A2 SULFONAMIDE DERIVATIVES AS PPAR MODULATORS ELI LILLY AND COMPANY (US) 2004-09-02 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 (3 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-20050148624-A1 Jnk inhibitor MAPK3, MAPKAPK3, MAPK1 DNM1 3714/4885ANPEP 3128/4885ERAP2 4606/4885
US-20250296939-A1 BENZOTHIOPHENE COMPOUND NFE2L2, KEAP1, BPTF DNM1 4032/4885ANPEP 4458/4885ERAP2 3677/4885
US-20060217433-A1 Sulfonamide derivatives as ppar modulators PPARD, PPARA, PPARG DNM1 2651/4885ANPEP 3894/4885ERAP2 2000/4885

“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.