SCHEMBL2799735

SCHEMBL2799735

Cc1ccc(F)c(Nc2c(C(=O)N3CCC(c4ccc(F)cc4)CC3)cnc3c(C(=O)O)cnn23)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FASN P49327 5/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
ALDH1A1 P00352 1/20 0.39
DHODH Q02127 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
PRSS12 P56730 2/20 0.38
EGLN1 Q9GZT9 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
RUVBL1 Q9Y265 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
SCHEMBL2801655 0.94 ALDH1A1 (0.41) FASNMAPTLMNATP53ALDH1A1
SCHEMBL2799665 0.93 FASN (0.42) FASNMAPTLMNATP53THRB
SCHEMBL2801212 0.93 DHODH (0.37) FASNMAPTLMNATP53THRB
SCHEMBL2800966 0.92 FASN (0.40) FASNMAPTTP53ALDH1A1DHODH
SCHEMBL2799695 0.91 KDM4E (0.41) FASNMAPTLMNATP53THRB
SCHEMBL2803138 0.90 TP53 (0.42) MAPTLMNATP53THRBALDH1A1
SCHEMBL2800543 0.90 EGLN1 (0.37) MAPTLMNATP53ALDH1A1DHODH
SCHEMBL2803080 0.89 FASN (0.39) FASNMAPTLMNATP53THRB
SCHEMBL2801670 0.89 FASN (0.39) FASNMAPTLMNATP53THRB
SCHEMBL2801551 0.89 FASN (0.39) FASNMAPTLMNATP53THRB

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
EP-2206714-B1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES KYOWA HAKKO KIRIN CO LTD (JP) 2015-01-21 EP disclosed
US-8729264-B2 Agent for prevention and/or treatment of skin diseases KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-05-20 US disclosed
US-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-10-07 US disclosed
EP-2206714-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES Kyowa Hakko Kirin Co., Ltd. (JP) 2010-07-14 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-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES TYR, CUTA, SERPINB1 FASN 4286/4885MAPT 2533/4885LMNA 2418/4885

“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.