SCHEMBL6404680

SCHEMBL6404680

O=C(Nc1ccccc1-c1nnn[nH]1)c1ccc(Sc2ccc3ccccc3c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.42
NPC1 O15118 5/20 0.42
RAB9A P51151 5/20 0.42
KDM4E B2RXH2 3/20 0.39
NR1H4 Q96RI1 2/20 0.39
TDP1 Q9NUW8 3/20 0.38
MAPT P10636 1/20 0.38
ABCG2 Q9UNQ0 2/20 0.38
ABCB1 P08183 1/20 0.38
KCNK2 O95069 1/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
SIRT3 Q9NTG7 1/20 0.37
GLA P06280 1/20 0.37

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
SCHEMBL6408466 0.85 GPR35 (0.47) GPR35NPC1RAB9AMAPTABCG2
SCHEMBL13300574 0.81 ABCG2 (0.52) GPR35NPC1RAB9AKDM4ETDP1
SCHEMBL7432239 0.79 GPR35 (0.46) GPR35NPC1RAB9AKDM4ETDP1
SCHEMBL6784145 0.76 TERT (0.61) NPC1RAB9AKDM4EMAPTGAA
SCHEMBL7436468 0.76 NPC1 (0.56) NPC1RAB9AMAPTABCG2ALDH1A1
SCHEMBL23796603 0.73 NPC1 (0.41) NPC1RAB9AKDM4EMAPTKCNK2
SCHEMBL3279060 0.73 HCAR2 (0.47) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL3745750 0.73 HCAR2 (0.52) MEN1KMT2A
SCHEMBL3279047 0.73 HCAR2 (0.47) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL4422766 0.73 GPR35 (0.52) GPR35NPC1RAB9ATDP1MAPT

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-20050027008-A1 Cancer remedy comprising anthranilic acid derivatives as active ingredient TEIJIN LIMITED 2005-02-03 US disclosed
US-20030220402-A1 Cancer remedy comprising anthranilic acid derivatives as active ingredients TEIJIN LIMITED (JP) 2003-11-27 US disclosed
EP-1256341-A1 CANCER REMEDY COMPRISING ANTHRANILIC ACID DERIVATIVE AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 2002-11-13 EP disclosed
CN-1048239-C Naphthalene deriv. TEIJIN LTD (JP) 2000-01-12 CN disclosed
CN-1153511-A Naphthalene deriv. TEIJIN LTD (JP) 1997-07-02 CN 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 (2 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-20030220402-A1 Cancer remedy comprising anthranilic acid derivatives as active ingredients HCCS, BCOR, CBR1 GPR35 3306/4885NPC1 987/4885RAB9A 1032/4885
US-20050027008-A1 Cancer remedy comprising anthranilic acid derivatives as active ingredient CA9, HCCS, CA7 GPR35 2790/4885NPC1 3207/4885RAB9A 294/4885

“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.