SCHEMBL6512206

SCHEMBL6512206

O=C(O)Cc1c[nH]c2c(F)cc(Cl)cc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.49
GPR84 Q9NQS5 2/20 0.45
LMNA P02545 2/20 0.43
ALDH1A1 P00352 1/20 0.43
GLA P06280 1/20 0.43
CYP2C9 P11712 1/20 0.43
HPGD P15428 1/20 0.43
NFKB1 P19838 1/20 0.43
PMP22 Q01453 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TNF P01375 2/20 0.42
ICMT O60725 1/20 0.40
MAP2 P11137 1/20 0.40
MPO P05164 3/20 0.40
KDM4E B2RXH2 1/20 0.40
AR P10275 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
GPR17 Q13304 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL14487642 0.84 GPR84 (0.65) TSHRGPR84LMNAALDH1A1GLA
SCHEMBL8528469 0.84 GPR17 (0.46) TSHRLMNAALDH1A1GLACYP2C9
SCHEMBL6510085 0.82 TSHR (0.49) TSHRGPR84LMNAALDH1A1GLA
SCHEMBL5066540 0.75 GPR84 (0.65) TSHRGPR84LMNAALDH1A1GLA
Hydrochloric Acid SCHEMBL21546049 0.75 MPO (0.55) GPR84PMP22NPSR1MPOSMN1; SMN2
SCHEMBL27858184 0.73 KEAP1 (0.39) TSHRLMNAALDH1A1GLACYP2C9
SCHEMBL1615011 0.72 TSHR (0.69) TSHRGPR84LMNAALDH1A1GLA
SCHEMBL14484644 0.71 TSHR (0.67) TSHRGPR84LMNAALDH1A1GLA
SCHEMBL29651073 0.71 TSHR (0.67) TSHRGPR84LMNAALDH1A1GLA
SCHEMBL23701729 0.70 ICMT (0.80) TSHRGPR84LMNAALDH1A1GLA

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-20050203166-A1 Indole-3-acetic acid derivatives CANCER RESEARCH TECHNOLOGY LIMITED 2005-09-15 US disclosed
US-6890948-B1 Use of indole-3-acetic acid derivatives in medicine CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2005-05-10 US disclosed
EP-1296676-B1 USE OF INDOLE-3-ACETIC ACID DERIVATIVES IN MEDICINE CANCER REC TECH LTD (GB) 2004-01-28 EP disclosed
EP-1296676-A1 USE OF INDOLE-3-ACETIC ACID DERIVATIVES IN MEDICINE Cancer Research Technology Limited (GB) 2003-04-02 EP disclosed
WO-2002002110-A1 USE OF INDOLE-3-ACETIC ACID DERIVATIVES IN MEDICINE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2002-01-10 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-20050203166-A1 Indole-3-acetic acid derivatives ADCY3, GPR3, HCAR3 TSHR 823/4885GPR84 217/4885LMNA 4515/4885

“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.