SCHEMBL30839737

SCHEMBL30839737

Nc1cc(Cl)cc(-c2cc(Cl)ccc2N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.46
TSHR P16473 3/20 0.46
ALDH1A1 P00352 3/20 0.46
ALOX15 P16050 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
TP53 P04637 2/20 0.46
IDO1 P14902 5/20 0.42
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
DYRK3 O43781 1/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CDK5 Q00535 1/20 0.36
DYRK1A Q13627 1/20 0.36
CDK5R1 Q15078 1/20 0.36
DYRK2 Q92630 1/20 0.36
DYRK1B Q9Y463 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
SCHEMBL27185984 1.00 CYP3A4 (0.46) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
SCHEMBL30839801 1.00 CYP3A4 (0.46) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
SCHEMBL14907071 0.81 TSHR (0.56) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
SCHEMBL28316014 0.79 CYP3A4 (0.44) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
SCHEMBL5532978 0.79 CYP3A4 (0.50) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
SCHEMBL1577931 0.79 TSHR (0.54) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
SCHEMBL11517368 0.78 TSHR (0.65) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
SCHEMBL30839728 0.78 TSHR (0.65) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
Hydrochloric Acid SCHEMBL6572516 0.78 CYP3A4 (0.42) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2
SCHEMBL1824521 0.75 ALDH1A1 (0.54) CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2

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 4 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
WO-2024068129-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE INGEVITY UK LTD. (GB) 2024-04-04 WO disclosed