SCHEMBL30839710

SCHEMBL30839710

COc1cc(N)cc(-c2cc(OC)ccc2N)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
CYP3A4 P08684 5/20 0.47
ABL1 P00519 2/20 0.44
ABCB1 P08183 2/20 0.44
BCR P11274 2/20 0.44
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
MAPT P10636 4/20 0.43
THRB P10828 2/20 0.43
TDP1 Q9NUW8 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2D6 P10635 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
MAPK1 P28482 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
GAA P10253 2/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL27185994 1.00 ALDH1A1 (0.47) ALDH1A1CYP3A4ABL1ABCB1BCR
SCHEMBL30839726 1.00 ALDH1A1 (0.47) ALDH1A1CYP3A4ABL1ABCB1BCR
SCHEMBL3789559 0.82 ABL1 (0.53) ALDH1A1CYP3A4ABL1ABCB1BCR
SCHEMBL3789140 0.81 TDP1 (0.56) ALDH1A1CYP3A4ABL1ABCB1BCR
SCHEMBL6572399 0.81 ABL1 (0.47) ALDH1A1CYP3A4ABL1ABCB1BCR
SCHEMBL3790187 0.81 CYP3A4 (0.58) ALDH1A1CYP3A4MEN1KMT2AMAPT
SCHEMBL11004268 0.80 ALDH1A1 (0.61) ALDH1A1CYP3A4MEN1KMT2AMAPT
SCHEMBL30206740 0.80 ALDH1A1 (0.61) ALDH1A1CYP3A4MEN1KMT2AMAPT
SCHEMBL30206743 0.80 ALDH1A1 (0.61) ALDH1A1CYP3A4MEN1KMT2AMAPT
SCHEMBL28255761 0.80 TDO2 (0.55) ALDH1A1CYP3A4ABL1ABCB1BCR

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