SCHEMBL10535486

SCHEMBL10535486

CCCCCCN1c2cc(N)ccc2Nc2ccc(N)cc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 8/20 0.41
PTGS1 P23219 3/20 0.39
PTGS2 P35354 3/20 0.39
MGLL Q99685 2/20 0.39
FAAH O00519 1/20 0.39
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
CNR2 P34972 3/20 0.37
CES1 P23141 2/20 0.37
CDC25A P30304 1/20 0.37
CNR1 P21554 1/20 0.37

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
SCHEMBL10423559 0.98 CYP19A1 (0.40) CYP19A1PTGS1PTGS2MGLLFAAH
SCHEMBL81073 0.78 ALDH1A1 (0.40) PTGS1PTGS2MGLLFAAHMEN1
SCHEMBL3899878 0.74 MEN1 (0.42) MEN1MAPTKMT2A
SCHEMBL23954272 0.73 PIM1 (0.56) MEN1POLBMAPTKMT2A
SCHEMBL7164942 0.71 GAA (0.46) MEN1MAPTKMT2ACES1CDC25A
SCHEMBL14560519 0.69 HSD17B10 (0.62) CYP19A1PTGS1PTGS2MGLLFAAH
SCHEMBL30141987 0.68 CDC25A (0.61) PTGS1PTGS2MGLLFAAHMEN1
SCHEMBL3635173 0.68 CDC25A (0.61) PTGS1PTGS2MGLLFAAHMEN1
SCHEMBL5903145 0.67 ATAD2 (0.51) CYP19A1PTGS1PTGS2MGLLFAAH
SCHEMBL11878800 0.67 HSD17B10 (0.64) CYP19A1MEN1USP2MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4857438-A Photochromic system and layers produced therewith BASF AKTIENGESELLSCHAFT (DE) 1989-08-15 US disclosed
US-4332884-A USING A DIOXIME CHELATING AGENT RICOH CO., LTD. (JP) 1982-06-01 US disclosed
US-4315068-A CONTAINING A COBALT-AMMINE COMPLEX AND A DIOXIME OR A BISIMIDAZOLIN-3-ONE CHELATING AGENT; STABILITY; COLOR DILMS RICOH CO., LTD. (JP) 1982-02-09 US disclosed
US-4306014-A AMMONIA OR AMINES SUPPRESS THE COLOR-FORMING REACTION SYSTEM RICOH CO., LTD. (JP) 1981-12-15 US disclosed
US-4251619-A Process for forming photo-polymeric image KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-02-17 US disclosed