SCHEMBL17109312

SCHEMBL17109312

CCc1ccc2c(-c3ccccc3C(=O)NN)c3ccc(=[N+](CC)CC)cc-3oc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FPR2 P25090 4/20 0.46
▸ ABCB1 P08183 1/20 0.46
▸ USP2 O75604 3/20 0.45
▸ CFTR P13569 1/20 0.45
▸ PAX8 Q06710 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ GOPC Q9HD26 1/20 0.45
▸ TGM2 P21980 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ BLM P54132 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ NCOR2 Q9Y618 1/20 0.42
▸ TLR7 Q9NYK1 1/20 0.41
▸ P2RY6 Q15077 1/20 0.39
▸ AVPR2 P30518 2/20 0.37
▸ NPY4R P50391 3/20 0.36
▸ THRB P10828 1/20 0.36

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
SCHEMBL17109310 0.89 ABCB1 (0.44) FPR2ABCB1USP2CFTRPAX8
SCHEMBL16066044 0.81 FPR2 (0.57) FPR2ABCB1USP2TGM2MEN1
SCHEMBL18637090 0.80 ABCB1 (0.56) FPR2ABCB1USP2CFTRPAX8
SCHEMBL12763953 0.80 MEN1 (0.44) FPR2ABCB1USP2CFTRPAX8
SCHEMBL20192210 0.79 ABCB1 (0.55) FPR2ABCB1USP2CFTRPAX8
SCHEMBL12118351 0.79 MEN1 (0.59) FPR2USP2TGM2MEN1BLM
SCHEMBL12763951 0.79 POLB (0.50) FPR2ABCB1USP2CFTRPAX8
SCHEMBL19494774 0.79 USP2 (0.53) FPR2ABCB1USP2CFTRPAX8
SCHEMBL20078094 0.77 FPR2 (0.57) FPR2ABCB1USP2TGM2MEN1
SCHEMBL9007850 0.77 USP2 (0.59) FPR2ABCB1USP2CFTRPAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150266332-A1 ENCRYPTED OPTICAL MARKERS FOR SECURITY APPLICATIONS APDN (B.V.I.) INC. (VG) 2015-09-24 — — US disclosed
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