SCHEMBL8631796

SCHEMBL8631796

Cc1ccccc1N(C(=N)N)c1ccccc1C.N=C(N)N(c1ccccc1)c1ccccc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
SIGMAR1 Q99720 3/20 0.41
NPSR1 Q6W5P4 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HTR3E A5X5Y0 1/20 0.34
HTR3B O95264 1/20 0.34
HTR3A P46098 1/20 0.34
HTR3D Q70Z44 1/20 0.34
HTR3C Q8WXA8 1/20 0.34
TSHR P16473 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
F2 P00734 1/20 0.33
F10 P00742 1/20 0.33
F12 P00748 1/20 0.33
F7 P08709 1/20 0.33
F3 P13726 1/20 0.33
PKM P14618 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 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
SCHEMBL30876209 0.95 ALDH1A1 (0.44) ALDH1A1SIGMAR1NPSR1MEN1KMT2A
SCHEMBL28495932 0.95 ALDH1A1 (0.44) ALDH1A1SIGMAR1NPSR1MEN1KMT2A
SCHEMBL78987 0.91 SIGMAR1 (0.44) SIGMAR1TSHRTRPM8F2F10
Hydrochloric Acid SCHEMBL8745417 0.89 SIGMAR1 (0.43) SIGMAR1KMT2ATSHRTRPM8F2
Methane SCHEMBL28288691 0.89 SIGMAR1 (0.43) ALDH1A1SIGMAR1TSHRTRPM8F2
Hydrochloric Acid SCHEMBL11493379 0.87 SIGMAR1 (0.42) ALDH1A1SIGMAR1TSHRTRPM8F2
Thiourea SCHEMBL28193664 0.85 SIGMAR1 (0.41) ALDH1A1SIGMAR1TSHRTRPM8GAA
Boric Acid SCHEMBL6910845 0.85 SIGMAR1 (0.41) ALDH1A1SIGMAR1TSHRTRPM8F2
SCHEMBL27517260 0.83 SIGMAR1 (0.42) ALDH1A1SIGMAR1NPSR1MEN1KMT2A
SCHEMBL36862 0.82 ALDH1A1 (0.58) ALDH1A1SIGMAR1NPSR1MEN1KMT2A

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
US-5763558-A HARDENING NOVOLAK RESIN USING SUBSTITUTED MELAMINE AND SPECIFIED AMIDE, UREA OR IMIDE COMPOUND COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN-MICHELIN & CIE (FR) 1998-06-09 US disclosed
US-5718788-A REINFORCEMENT FOR RUBBERS; TIRES COMPAGNIE GENERALE ESTABLISSEMENTS MICHELIN - MICHELIN & CIE (FR) 1998-02-17 US disclosed
EP-0649446-A1 METHOD AND COMPOSITION FOR USING SUBSTITUTED MELAMINES AS NOVOLAK RESIN CURING AGENTS COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN-MICHELIN & CIE (FR) 1995-04-26 EP disclosed
WO-1994001493-A1 METHOD AND COMPOSITION FOR USING SUBSTITUTED MELAMINES AS NOVOLAK RESIN CURING AGENTS COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN - MICHELIN & CIE (FR) 1994-01-20 WO disclosed