SCHEMBL29640642

SCHEMBL29640642

O=C(O)COc1cccc(-c2ocnc2-c2nc(-c3ccccc3)c(-c3ccccc3)o2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 1.00
MEN1 O00255 1/20 1.00
ALDH1A1 P00352 1/20 1.00
CYP1A2 P05177 1/20 1.00
CYP3A4 P08684 1/20 1.00
CYP2D6 P10635 1/20 1.00
HPGD P15428 1/20 1.00
KMT2A Q03164 1/20 1.00
HSD17B10 Q99714 1/20 1.00
FABP4 P15090 8/20 0.72
PTGIR P43119 8/20 0.52
RXRA P19793 1/20 0.47
RXRB P28702 1/20 0.47
PTGER4 P35408 1/20 0.46
PTGER3 P43115 1/20 0.46
FABP5 Q01469 3/20 0.45
FABP3 P05413 2/20 0.45
PPARD Q03181 1/20 0.44
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43

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
SCHEMBL674739 1.00 KDM4E (1.00) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL19163857 0.92 KDM4E (0.85) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL9428515 0.90 MEN1 (0.82) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL9593239 0.89 ALDH1A1 (0.80) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL9428853 0.86 KDM4E (0.76) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL8066970 0.85 FABP4 (0.79) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL14698129 0.85 KDM4E (0.74) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL9594904 0.84 KDM4E (0.72) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL9428317 0.84 FABP4 (1.00) KDM4EMEN1ALDH1A1CYP1A2CYP3A4
SCHEMBL30398835 0.84 FABP4 (1.00) KDM4EMEN1ALDH1A1CYP1A2CYP3A4

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250205518-A1 PULMONARY HYPERTENSION TREATMENT SONIVIE LTD. (IL) 2025-06-26 US disclosed
US-12251582-B2 Pulmonary hypertension treatment SONIVIE LTD. (IL) 2025-03-18 US disclosed
US-20240100018-A1 COMPOUNDS FOR THE TREATMENT OF A DISEASE OR DISORDER, METHODS FOR IDENTIFYING SAID COMPOUNDS CEDARS-SINAI MEDICAL CENTER 2024-03-28 US disclosed
CN-116211904-B Donggui extract and its extraction method and application 广州青岚生物科技有限公司 2023-08-29 CN disclosed
CN-116211904-A Donggui extract and its extraction method and application 广州青岚生物科技有限公司 2023-06-06 CN disclosed
US-20220241617-A1 PULMONARY HYPERTENSION TREATMENT SONIVIE LTD. (IL) 2022-08-04 US disclosed
US-20220244263-A1 METHODS FOR TREATING SMALL CELL NEUROENDOCRINE AND RELATED CANCERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-08-04 US disclosed
US-11318331-B2 Pulmonary hypertension treatment SONIVIE LTD. (IL) 2022-05-03 US disclosed