SCHEMBL4123362

SCHEMBL4123362

CCc1cccc(C(O)c2cc(Cl)ccc2NCc2ccc(OC)cc2OC)c1OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
HPGD P15428 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
LPAR1 Q92633 3/20 0.42
KDM4C Q9H3R0 2/20 0.42
TSHR P16473 4/20 0.40
KDM4E B2RXH2 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 2/20 0.40
GAA P10253 1/20 0.40
APLNR P35414 1/20 0.40
ABCB1 P08183 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.38
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 3/20 0.38
CYP2D6 P10635 3/20 0.38
CYP2C19 P33261 3/20 0.38
CLK4 Q9HAZ1 2/20 0.38

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
SCHEMBL4121857 0.92 TAS1R3 (0.44) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4123383 0.91 TAS1R3 (0.43) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4111042 0.90 TSHR (0.42) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4123165 0.90 KDM4E (0.42) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4123181 0.90 TAS1R3 (0.42) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4123470 0.89 ALDH1A1 (0.42) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4113260 0.89 TAS1R3 (0.42) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4119617 0.88 TAS1R3 (0.49) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4122265 0.87 TAS1R3 (0.44) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1
SCHEMBL4111974 0.87 ALDH1A1 (0.44) ALDH1A1HPGDSMN1; SMN2TAS1R3TAS1R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
EP-1939205-A1 TRICYCLIC COMPOUND Daiichi Sankyo Company, Limited (JP) 2008-07-02 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-20090181942-A1 TRICYCLIC COMPOUNDS FDFT1, COASY, HMGCR ALDH1A1 1587/4885HPGD 1028/4885SMN1; SMN2 4445/4885

“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.