SCHEMBL4568261

SCHEMBL4568261

COc1cc2cc(-c3ccccc3F)[nH]c2cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
KMT2A Q03164 3/20 0.50
MAPT P10636 3/20 0.50
RAB9A P51151 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MEN1 O00255 2/20 0.50
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
FFAR1 O14842 1/20 0.43
MAP2 P11137 1/20 0.41
F10 P00742 2/20 0.41
PLAU P00749 2/20 0.41
PLAT P00750 2/20 0.41
KLKB1 P03952 2/20 0.41
PRSS1 P07477 2/20 0.41
PRSS2 P07478 2/20 0.41
F7 P08709 2/20 0.41
PRSS3 P35030 2/20 0.41
ORAI1 Q96D31 1/20 0.40

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
SCHEMBL6118011 0.87 KDM4E (0.54) KDM4EKMT2AMAPTRAB9AALDH1A1
SCHEMBL4568256 0.80 RAB9A (0.57) KDM4EKMT2AMAPTRAB9AALDH1A1
SCHEMBL6116673 0.78 TNKS (0.46) KDM4EKMT2AMAPTRAB9AALDH1A1
SCHEMBL6117305 0.77 ALDH1A1 (0.55) KDM4EKMT2AMAPTRAB9AALDH1A1
SCHEMBL6118322 0.76 RAB9A (0.64) KDM4EKMT2AMAPTRAB9AALDH1A1
SCHEMBL4568259 0.71 KDM4E (0.57) KDM4EKMT2AMAPTRAB9AALDH1A1
SCHEMBL4568298 0.71 CYP19A1 (0.55) KDM4EKMT2AMAPTRAB9AMEN1
SCHEMBL11795033 0.71 KDR (0.58) KDM4EKMT2AMAPTRAB9AALDH1A1
SCHEMBL6117642 0.70 IMPDH2 (0.43) KDM4EKMT2AMAPTRAB9AALDH1A1
SCHEMBL4568293 0.70 PDGFRB (0.42) KDM4EKMT2AMAPTRAB9AALDH1A1

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-8680120-B2 Indole derivative or pharmaceutically acceptable salt thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2014-03-25 US disclosed
EP-2460791-A1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2012-06-06 EP disclosed
US-20120129890-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-24 US 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 (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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R KDM4E 3521/4885KMT2A 2056/4885MAPT 3199/4885
US-20120129890-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, ARRB1 KDM4E 3321/4885KMT2A 2189/4885MAPT 3309/4885

“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.