SCHEMBL11802422

SCHEMBL11802422

Cc1nc(Oc2ccccc2)nc(C(Cl)(Cl)Cl)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.42
PAX8 Q06710 1/20 0.42
KMT2A Q03164 7/20 0.38
MEN1 O00255 6/20 0.36
ALDH1A1 P00352 3/20 0.36
POLB P06746 2/20 0.36
CCNB2 O95067 1/20 0.36
CCNE2 O96020 1/20 0.36
CDK1 P06493 1/20 0.36
CDK4 P11802 1/20 0.36
CCNB1 P14635 1/20 0.36
CCNA2 P20248 1/20 0.36
CCND1 P24385 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
CCNB3 Q8WWL7 1/20 0.36
LTA4H P09960 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL14030941 0.82 PAX8 (0.58) HTTLMNAPAX8KMT2AMEN1
SCHEMBL14264137 0.82 HTT (0.53) HTTLMNAPAX8KMT2AMEN1
SCHEMBL17486267 0.77 LMNA (0.46) HTTLMNAPAX8KMT2AMEN1
SCHEMBL14030947 0.75 ALDH1A1 (0.55) HTTLMNAPAX8KMT2AMEN1
SCHEMBL28198420 0.74 PAX8 (0.50) HTTLMNAPAX8KMT2AMEN1
SCHEMBL9615303 0.74 ALDH1A1 (0.64) HTTKMT2AMEN1ALDH1A1LTA4H
SCHEMBL14030967 0.74 NPC1 (0.54) HTTLMNAPAX8KMT2AMEN1
SCHEMBL23139063 0.73 PAX8 (0.58) HTTLMNAPAX8KMT2AMEN1
SCHEMBL16253513 0.72 PAX8 (0.45) HTTLMNAPAX8KMT2AALDH1A1
SCHEMBL11256504 0.72 MAPT (0.58) HTTLMNAKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3987037-A RADIATION-SENSITIVE FREE RADICAL GENERATORS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1976-10-19 US disclosed
US-3954475-A Photosensitive elements containing chromophore-substituted vinyl-halomethyl-s-triazines MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1976-05-04 US disclosed