SCHEMBL30839747

SCHEMBL30839747

Nc1ccc(-c2cc(Cl)ccc2N)cc1Cl

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.64
TSHR P16473 4/20 0.64
ALDH1A1 P00352 3/20 0.61
MAPK1 P28482 2/20 0.61
ESR2 Q92731 1/20 0.52
ALOX15 P16050 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
TP53 P04637 1/20 0.46
IDO1 P14902 4/20 0.43
AHR P35869 3/20 0.41
RECQL P46063 1/20 0.41
HTR2B P41595 1/20 0.40
PDE4D Q08499 1/20 0.40
HPGD P15428 1/20 0.39
ALOX12 P18054 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL27185993 1.00 CYP3A4 (0.64) CYP3A4TSHRALDH1A1MAPK1ESR2
SCHEMBL2495842 0.90 AHR (0.52) CYP3A4TSHRALDH1A1MAPK1ESR2
SCHEMBL14907071 0.87 TSHR (0.56) CYP3A4TSHRALDH1A1MAPK1ALOX15
SCHEMBL1577931 0.85 TSHR (0.54) CYP3A4TSHRALDH1A1MAPK1ALOX15
SCHEMBL5532978 0.81 CYP3A4 (0.50) CYP3A4TSHRALDH1A1MAPK1ALOX15
SCHEMBL27499586 0.81 RECQL (0.59) CYP3A4TSHRALDH1A1MAPK1SMN1; SMN2
SCHEMBL23137332 0.80 CYP3A4 (0.70) CYP3A4TSHRALDH1A1MAPK1ESR2
SCHEMBL22816665 0.80 CYP3A4 (0.77) CYP3A4TSHRALDH1A1MAPK1ESR2
SCHEMBL2497592 0.80 TSHR (0.45) CYP3A4TSHRALDH1A1MAPK1ALOX15
SCHEMBL30839728 0.79 TSHR (0.65) CYP3A4TSHRALDH1A1MAPK1ALOX15

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 6 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-2025149744-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANE DISPERSIONS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-17 WO 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
WO-2025149744-A1 POLYCAPROLACTONE POLYOLS, POLYURETHANE DISPERSIONS, AND METHODS OF MAKING AND USING THE SAME INGEVITY UK LTD (GB) 2025-07-17 WO disclosed
WO-2024068129-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE INGEVITY UK LTD. (GB) 2024-04-04 WO disclosed