SCHEMBL29958016

SCHEMBL29958016

O=Cc1cc(Cl)ccc1F

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 9/20 0.59
TDP1 Q9NUW8 2/20 0.58
HSD17B10 Q99714 1/20 0.42
PTPN1 P18031 1/20 0.42
NFE2L2 Q16236 1/20 0.39
XDH P47989 1/20 0.39
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL42333 1.00 ERN1 (0.59) ERN1TDP1HSD17B10PTPN1NFE2L2
SCHEMBL155661 0.84 TDP1 (0.61) ERN1TDP1HSD17B10PTPN1LMNA
SCHEMBL4357334 0.80 TDP1 (0.70) ERN1TDP1HSD17B10PTPN1XDH
SCHEMBL14774600 0.80 TDP1 (0.52) ERN1TDP1PTPN1NFE2L2MEN1
SCHEMBL14774601 0.80 TDP1 (0.52) ERN1TDP1PTPN1NFE2L2MEN1
SCHEMBL22039183 0.79 ERN1 (0.42) ERN1TDP1HSD17B10NFE2L2XDH
SCHEMBL5175967 0.78 SOS1 (0.44) ERN1TDP1HSD17B10NFE2L2MEN1
SCHEMBL65723 0.78 ERN1 (0.56) ERN1PTPN1NFE2L2
Water SCHEMBL28578537 0.78 TDP1 (0.67) ERN1TDP1HSD17B10PTPN1XDH
SCHEMBL42560 0.78 TDP1 (0.67) ERN1TDP1HSD17B10PTPN1XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120152713-A Tricyclic aryl derivatives and compositions and methods thereof 昂胜医疗科技公司 2025-06-13 CN disclosed
EP-4161902-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. (US) 2023-04-12 EP disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed