SCHEMBL23870519

SCHEMBL23870519

CCOc1ccc(C2=CCC(C3CCC(CC4CC4)CC3)CC2)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 3/20 0.31
CDK9 P50750 3/20 0.31

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
SCHEMBL24462206 0.94 CCNT1 (0.33) CCNT1CDK9
SCHEMBL26216792 0.93 CCNT1 (0.31) CCNT1CDK9
SCHEMBL13922709 0.93 CCNT1 (0.31) CCNT1CDK9
SCHEMBL2215512 0.93 CCNT1 (0.31) CCNT1CDK9
SCHEMBL2214231 0.91 TLR4 (0.32) CCNT1CDK9
SCHEMBL14922521 0.91 PTGDR2 (0.32) CCNT1CDK9
SCHEMBL12511944 0.91 TLR4 (0.32) CCNT1CDK9
SCHEMBL18134232 0.91 TLR4 (0.32) CCNT1CDK9
SCHEMBL23623834 0.90 CCNT1 (0.32) CCNT1CDK9
SCHEMBL18136412 0.89 ALDH1A1 (0.33) CCNT1CDK9

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
WO-2022106387-A1 LIQUID CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2022-05-27 WO disclosed
US-20210301205-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY ELEMENT, AND LIQUID CRYSTAL DISPLAY SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2021-09-30 US disclosed