SCHEMBL30692015

SCHEMBL30692015

Nc1cccc2cnccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 1.00
CYP2D6 P10635 2/20 1.00
LMNA P02545 2/20 1.00
CYP1A2 P05177 1/20 1.00
CYP2C9 P11712 1/20 1.00
CYP2C19 P33261 1/20 1.00
KDM4E B2RXH2 2/20 0.59
MAPKAPK2 P49137 1/20 0.59
IMPDH2 P12268 4/20 0.55
ALDH1A1 P00352 2/20 0.54
HPGD P15428 2/20 0.54
TSHR P16473 2/20 0.54
HSD17B10 Q99714 2/20 0.54
KEAP1 Q14145 1/20 0.54
HTT P42858 2/20 0.53
MAPT P10636 2/20 0.49
AXL P30530 1/20 0.47
EP300 Q09472 1/20 0.47
KAT2B Q92831 1/20 0.47
KAT8 Q9H7Z6 1/20 0.47

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
SCHEMBL116945 1.00 CYP3A4 (1.00) CYP3A4CYP2D6LMNACYP1A2CYP2C9
Iodide SCHEMBL11812745 0.98 CYP3A4 (0.96) CYP3A4CYP2D6LMNACYP1A2CYP2C9
Hydrochloric Acid SCHEMBL1000639 0.98 CYP3A4 (0.96) CYP3A4CYP2D6LMNACYP1A2CYP2C9
SCHEMBL6065407 0.85 CYP3A4 (0.72) CYP3A4CYP2D6LMNACYP1A2CYP2C9
SCHEMBL9746696 0.84 CYP3A4 (0.72) CYP3A4CYP2D6LMNACYP1A2CYP2C9
Acrylamide SCHEMBL6582120 0.83 CYP3A4 (0.70) CYP3A4CYP2D6LMNACYP1A2CYP2C9
SCHEMBL619775 0.83 CYP3A4 (0.70) CYP3A4CYP2D6LMNACYP1A2CYP2C9
SCHEMBL29557996 0.83 CYP3A4 (0.70) CYP3A4CYP2D6LMNACYP1A2CYP2C9
SCHEMBL9284399 0.82 LMNA (0.68) CYP3A4CYP2D6LMNACYP1A2CYP2C9
Methane SCHEMBL27204481 0.81 CYP3A4 (0.68) CYP3A4CYP2D6LMNACYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4581017-A1 NEW N-HETEROARYLBENZAMIDES DERIVATIVES AS FLT3 INHIBITORS Biodol Therapeutics (FR) 2025-07-09 EP disclosed
US-20240182482-A1 FUSED CYCLIC COMPOUND AS WEE-1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF Wigen Biomedicine Technology (shanghai) Co., Ltd. (CN) 2024-06-06 US disclosed
WO-2024079072-A1 NEW N-HETEROARYLBENZAMIDES DERIVATIVES AS FLT3 INHIBITORS BIODOL THERAPEUTICS (FR) 2024-04-18 WO disclosed
EP-4332104-A1 FUSED RING COMPOUND AS WEE-1 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF Wigen Biomedicine Technology (Shanghai) Co., Ltd. (CN) 2024-03-06 EP disclosed
CN-117377671-A Diacylglycerol kinase modulating compounds 吉利德科学公司 2024-01-09 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240182482-A1 FUSED CYCLIC COMPOUND AS WEE-1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, WEE2, WASF2 CYP3A4 1906/4885CYP2D6 2299/4885LMNA 3388/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.