SCHEMBL25599865

SCHEMBL25599865

CC1(c2ccc(N)c(F)c2)C=CC=CC1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32

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
SCHEMBL30404797 0.78 MAOB (0.34)
SCHEMBL29136559 0.72 MAOB (0.34)
SCHEMBL30217567 0.70 MAPK1 (0.34)
SCHEMBL28478060 0.70 CHRNA1 (0.37) ALDH1A1
SCHEMBL9629458 0.70 HDAC4 (0.36) ALDH1A1
SCHEMBL26305557 0.69
SCHEMBL13750264 0.69 HCAR3 (0.35)
Phosphine SCHEMBL27942052 0.68 HDAC4 (0.35) ALDH1A1
SCHEMBL6932784 0.68 CYP3A4 (0.31)
SCHEMBL29818664 0.67

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
EP-4198164-A1 MIXED LAYER, METHOD OF PREPARING THE MIXED LAYER, LIGHT-EMITTING DEVICE, AND ELECTRONIC APPARATUS Samsung Electronics Co., Ltd. (KR) 2023-06-21 EP disclosed