SCHEMBL4568171

SCHEMBL4568171

CC(C)(C)c1[nH]c2cc(F)ccc2c1Cc1cccc(C(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MAP2K4 P45985 1/20 0.45
MRGPRX4 Q96LA9 5/20 0.44
HCAR2 Q8TDS4 1/20 0.41
NR1H4 Q96RI1 1/20 0.40
NR4A2 P43354 1/20 0.39
KIF11 P52732 1/20 0.39
FOLH1 Q04609 1/20 0.39
GPR17 Q13304 1/20 0.38
SLC16A3 O15427 1/20 0.38

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
SCHEMBL4568122 0.88 MRGPRX4 (0.47) MEN1KMT2AMAP2K4MRGPRX4KIF11
SCHEMBL4568168 0.87 MRGPRX4 (0.48) MRGPRX4NR1H4KIF11FOLH1GPR17
SCHEMBL4568147 0.86 ENPP2 (0.48) MRGPRX4GPR17
SCHEMBL4568165 0.86 GPR17 (0.43) MRGPRX4NR1H4NR4A2KIF11FOLH1
SCHEMBL4568146 0.84 MRGPRX4 (0.49) MRGPRX4NR1H4GPR17
SCHEMBL4568132 0.82 MAP2K4 (0.50) MAP2K4MRGPRX4GPR17
SCHEMBL4568118 0.76 RAB9A (0.47) MRGPRX4KIF11
SCHEMBL4568120 0.76 RAB9A (0.47) MRGPRX4NR4A2KIF11
SCHEMBL4568107 0.75 RAB9A (0.46) MEN1KMT2AMRGPRX4KIF11GPR17
SCHEMBL4572091 0.75 LOXL2 (0.47) MRGPRX4KIF11

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-2474530-B1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL (JP) 2014-09-03 EP disclosed
EP-2474530-A1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2012-07-11 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 MEN1 2993/4885KMT2A 2056/4885MAP2K4 3448/4885

“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.