SCHEMBL30839718

SCHEMBL30839718

Nc1ccc(-c2cccc(N)c2Cl)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.45
TSHR P16473 4/20 0.45
PLA2G7 Q13093 1/20 0.44
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
ALDH1A1 P00352 9/20 0.40
HPGD P15428 3/20 0.40
ALOX15 P16050 2/20 0.40
CASP1 P29466 2/20 0.40
RECQL P46063 2/20 0.40
THRB P10828 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
TDP1 Q9NUW8 2/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL27185944 1.00 CYP3A4 (0.45) CYP3A4TSHRPLA2G7NFKB1PMP22
SCHEMBL31607633 0.85 PLA2G7 (0.49) CYP3A4TSHRPLA2G7NFKB1PMP22
SCHEMBL27185966 0.85 PLA2G7 (0.49) CYP3A4TSHRPLA2G7NFKB1PMP22
SCHEMBL30839727 0.81 CYP3A4 (0.65) CYP3A4TSHRPLA2G7NFKB1PMP22
SCHEMBL302092 0.81 CYP3A4 (0.65) CYP3A4TSHRPLA2G7NFKB1PMP22
SCHEMBL31607601 0.81 ALDH1A1 (0.50) CYP3A4TSHRALDH1A1HPGDALOX15
SCHEMBL4196237 0.81 ALDH1A1 (0.50) CYP3A4TSHRALDH1A1HPGDALOX15
SCHEMBL7969110 0.79 PLA2G7 (0.66) CYP3A4TSHRPLA2G7NFKB1PMP22
Hydrochloric Acid SCHEMBL5800872 0.79 CYP3A4 (0.62) CYP3A4TSHRPLA2G7NFKB1PMP22
Hydrochloric Acid SCHEMBL7531143 0.79 CYP3A4 (0.62) CYP3A4TSHRPLA2G7NFKB1PMP22

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
EP-4594381-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE Ingevity UK Ltd (GB) 2025-08-06 EP claimed
WO-2024068129-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE INGEVITY UK LTD. (GB) 2024-04-04 WO claimed
EP-4594381-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE Ingevity UK Ltd (GB) 2025-08-06 EP disclosed
CN-120092033-A Novel polyurethane or polyurethane-urea compositions with enhanced low temperature properties 英格维蒂英国有限公司 2025-06-03 CN disclosed
WO-2024068129-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE INGEVITY UK LTD. (GB) 2024-04-04 WO disclosed