SCHEMBL30839728

SCHEMBL30839728

Nc1ccc(Cl)cc1-c1cc(Cl)ccc1N

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.65
CYP3A4 P08684 3/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
ALDH1A1 P00352 2/20 0.65
ALOX15 P16050 2/20 0.65
TDP1 Q9NUW8 1/20 0.65
TP53 P04637 1/20 0.55
IDO1 P14902 5/20 0.53
HPGD P15428 1/20 0.50
ALOX12 P18054 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
S100A4 P26447 1/20 0.46
RECQL P46063 1/20 0.45
HTR2B P41595 1/20 0.45
PDE4D Q08499 1/20 0.45
DYRK3 O43781 1/20 0.44
CCNA2 P20248 1/20 0.44
CDK2 P24941 1/20 0.44
CDK5 Q00535 1/20 0.44

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
SCHEMBL11517368 1.00 TSHR (0.65) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL9732124 0.90 TSHR (0.58) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL14907071 0.87 TSHR (0.56) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL1577931 0.85 TSHR (0.54) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL29010805 0.82 TSHR (0.50) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL5532978 0.81 CYP3A4 (0.50) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL1824521 0.81 ALDH1A1 (0.54) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL30978223 0.81 CYP3A4 (0.50) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL21933920 0.81 ALDH1A1 (0.54) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15
SCHEMBL22517366 0.81 CYP3A4 (0.50) TSHRCYP3A4SMN1; SMN2ALDH1A1ALOX15

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