SCHEMBL10364902

SCHEMBL10364902

Cc1nc(C(Br)Br)cn1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TNF P01375 2/20 0.41
HPGD P15428 1/20 0.40
BRD4 O60885 4/20 0.39
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
SOS1 Q07889 1/20 0.38
HRH1 P35367 1/20 0.38
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
NOTUM Q6P988 1/20 0.37
P2RX7 Q99572 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPK1 P28482 1/20 0.37
CHRNB2 P17787 1/20 0.37
CHRNA7 P36544 1/20 0.37
CHRNA4 P43681 1/20 0.37
CYP19A1 P11511 1/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 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
SCHEMBL23566142 0.87 TNF (0.41) TNFHPGDBRD4KMT2ASOS1
SCHEMBL10591648 0.84 KMT2A (0.40) TNFHPGDBRD4KMT2ASOS1
SCHEMBL16828803 0.79 BRD4 (0.53) TNFHPGDBRD4MAPTSOS1
SCHEMBL10581641 0.79 BRD4 (0.51) TNFHPGDBRD4SOS1KDM4E
SCHEMBL23566144 0.76 TNF (0.44) TNFHPGDBRD4SOS1POLB
SCHEMBL1045329 0.75 TLR8 (0.49) TNFHPGDBRD4MAPTKMT2A
SCHEMBL10591397 0.73 TNF (0.45) TNFHPGDBRD4MAPTKDM4E
Hydrochloric Acid SCHEMBL10695240 0.73 TLR8 (0.51) TNFHPGDBRD4MAPTKMT2A
SCHEMBL1417492 0.72 ALDH1A1 (0.46) TNFHPGDBRD4MAPTSOS1
SCHEMBL4734075 0.72 BRD4 (0.57) HPGDBRD4KMT2APOLBNOTUM

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
EP-0314478-B1 NOVEL IMIDAZOLE COMPOUNDS, PROCESS FOR PREPARATION THEREOF ANTIFUNGAL AGENT AND MILDEWPROOF AGENT SHIKOKU CHEMICALS CORPORATION (JP) 1990-09-05 EP disclosed
US-4912123-A Imidazole compound SHIKOKU CHEMICALS CORPORATION (JP) 1990-03-27 US disclosed
EP-0314478-A1 Novel imidazole compounds, process for preparation thereof antifungal agent and mildewproof agent SHIKOKU CHEMICALS CORPORATION (JP) 1989-05-03 EP disclosed
US-4720551-A Chlorothienyl-imidazole propenones SHIKOKU CHEMICALS CORPORATION (JP) 1988-01-19 US disclosed