SCHEMBL11368672

SCHEMBL11368672

CSC1C(=O)Nc2c(C)cccc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.40
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CREBBP Q92793 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA12 O43570 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CNR1 P21554 1/20 0.36
HTT P42858 1/20 0.36
GPR35 Q9HC97 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36
POLB P06746 1/20 0.35
AGTR1 P30556 1/20 0.33
PDE7A Q13946 1/20 0.33

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
SCHEMBL117727 0.81 CACNB4 (0.40) DAOALDH1A1CA1CA2CA12
SCHEMBL116597 0.81 ALDH1A1 (0.37) DDB1CRBNALDH1A1MEN1KMT2A
SCHEMBL10710508 0.81 DDB1 (0.37) DAODDB1CRBNALDH1A1CA1
SCHEMBL11094086 0.80 HTR1A (0.34) ALDH1A1MEN1KMT2AGAAHTR2C
SCHEMBL1321330 0.79 HTR2C (0.46) DDB1CRBNALDH1A1MEN1KMT2A
SCHEMBL10714048 0.78 ALDH1A1 (0.36) DAOALDH1A1KMT2ACA1CA2
SCHEMBL10711888 0.78 BRD4 (0.40) ALDH1A1CREBBPGSK3BMAPTHTR2B
SCHEMBL24112725 0.77 ALDH1A1 (0.43) DAODDB1CRBNALDH1A1MEN1
SCHEMBL24112230 0.77 ALDH1A1 (0.43) DAODDB1CRBNALDH1A1MEN1
SCHEMBL10714343 0.77 LMNA (0.41) DDB1CRBNALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4252723-A Air oxidation of oxindoles to isatins REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1981-02-24 US disclosed
US-4188325-A Isatin process and products REGENTS OF UNIVERSITY OF MINNESOTA (US) 1980-02-12 US disclosed
US-4186132-A Isatin products THE REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1980-01-29 US disclosed
US-RE29882-E SALT FORMATION, REARRANGEMENT, DESULFURIZATION OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1979-01-16 US disclosed
US-4056569-A Ortho-[(alkylthio)(aminocarbonyl)methyl]anilines THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1977-11-01 US disclosed
US-3996264-A Synthesis of oxindoles from anilines and intermediates therein THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1976-12-07 US disclosed
US-3972894-A Synthesis of oxindoles from anilines and β-thio carboxylic esters or amides THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1976-08-03 US disclosed
US-3960926-A Process for preparing azasulfonium halide salts THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1976-06-01 US disclosed
US-3954797-A Process for preparing azasulfonium halide salts CHROMALLOY AMERICAN CORPORATION (US) 1976-05-04 US disclosed