SCHEMBL6500619

SCHEMBL6500619

Cc1cc(OCc2c(Cl)cccc2C(=O)O)cc2c1nc(C)n2Cc1ccc(-c2ccccc2)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3C2B O00750 4/20 0.42
NR1H4 Q96RI1 2/20 0.39
DHODH Q02127 3/20 0.39
NR1I2 O75469 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
BCL2 P10415 5/20 0.38
MCL1 Q07820 5/20 0.38
PIK3CB P42338 2/20 0.38
ALOX5AP P20292 2/20 0.37
AGTR1 P30556 1/20 0.36
AGTR2 P50052 1/20 0.36

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
SCHEMBL6488163 0.93 PIK3C2B (0.37) PIK3C2BNR1H4DHODHNR1I2CYP1A2
SCHEMBL6501134 0.91 BCL2 (0.47) PIK3C2BDHODHBCL2MCL1PIK3CB
SCHEMBL6502905 0.88 PIK3C2B (0.41) PIK3C2BDHODHBCL2MCL1PIK3CB
SCHEMBL6487917 0.88 PIK3C2B (0.39) PIK3C2BDHODHBCL2MCL1AGTR1
SCHEMBL6501228 0.88 BCL2 (0.40) PIK3C2BDHODHBCL2MCL1ALOX5AP
SCHEMBL6502827 0.87 ALOX5AP (0.41) PIK3C2BDHODHBCL2MCL1ALOX5AP
SCHEMBL6500643 0.87 ALOX5AP (0.40) PIK3C2BDHODHBCL2MCL1ALOX5AP
SCHEMBL6498787 0.85 BCL2 (0.40) PIK3C2BBCL2MCL1ALOX5APAGTR1
SCHEMBL6491148 0.85 DCTPP1 (0.45) DHODHBCL2MCL1ALOX5AP
SCHEMBL6500738 0.85 PIK3C2B (0.38) PIK3C2BDHODHBCL2MCL1ALOX5AP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014812-A1 Benzimidazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-01-20 US 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-20050014812-A1 Benzimidazole compounds SLC5A1, SLC5A2, G6PD PIK3C2B 2433/4885NR1H4 1441/4885DHODH 759/4885

“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.