SCHEMBL4568289

SCHEMBL4568289

CCOc1cc2[nH]c(-c3ccc(F)cc3)cc2cc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 2/20 0.42
AURKA O14965 1/20 0.40
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40
TTK P33981 1/20 0.40
PDE10A Q9Y233 1/20 0.39
FGFR2 P21802 2/20 0.38
KIT P10721 2/20 0.38
FGFR1 P11362 1/20 0.38
SSTR3 P32745 1/20 0.38
SSTR5 P35346 1/20 0.38
KCNH2 Q12809 1/20 0.38
CTSV O60911 1/20 0.38
CTSL P07711 1/20 0.38
F2 P00734 1/20 0.37
F10 P00742 1/20 0.37
PLG P00747 1/20 0.37
PLAU P00749 1/20 0.37
PLAT P00750 1/20 0.37
CYP1A2 P05177 2/20 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
SCHEMBL4568287 0.89 NPC1 (0.47) AURKACCNA2CDK2TTKPDE10A
SCHEMBL4568307 0.88 CYP1A1 (0.48) CYP1A1AURKACCNA2CDK2TTK
SCHEMBL4568288 0.82 CCNB2 (0.37) CYP1A1AURKACCNA2CDK2TTK
SCHEMBL4568290 0.80 CYP19A1 (0.51) AURKACCNA2CDK2TTKPDE10A
SCHEMBL4568275 0.79 MAPT (0.46) FGFR2KITFGFR1MEN1KMT2A
SCHEMBL6116903 0.78 TNKS (0.48) CYP1A1CTSVCTSLCYP1A2MEN1
SCHEMBL4568270 0.76 CYP1A1 (0.52) CYP1A1CTSVCTSLMEN1KMT2A
SCHEMBL4568292 0.74 CYP1A1 (0.51) CYP1A1KITCYP1A2MEN1KMT2A
SCHEMBL4568305 0.73 NPC1 (0.48) AURKACCNA2CDK2TTKPDE10A
SCHEMBL4568254 0.72 RAB9A (0.57) F2F10PLAUPLATMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2474530-B1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL (JP) 2014-09-03 EP disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R CYP1A1 996/4885AURKA 3492/4885CCNA2 3819/4885

“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.