SCHEMBL30587236

SCHEMBL30587236

OC1OCCc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
RAB9A P51151 3/20 0.44
KMT2A Q03164 3/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 2/20 0.41
MAPK1 P28482 1/20 0.41
MEN1 O00255 1/20 0.41
BLM P54132 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 1/20 0.41
ACP3 P15309 1/20 0.41
RECQL P46063 1/20 0.40
HTR2A P28223 2/20 0.39
RET P07949 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
XBP1 P17861 1/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL7343966 1.00 ALDH1A1 (0.44) ALDH1A1RAB9AKMT2ALMNAGAA
SCHEMBL30816126 0.80 ALDH1A1 (0.44) ALDH1A1RAB9AKMT2ALMNAGAA
SCHEMBL18338817 0.78 YWHAG (0.59) ALDH1A1LMNAGAATSHRMAPK1
SCHEMBL24999225 0.78 MAOA (0.41) RAB9ALMNASMN1; SMN2ACP3HTR2A
SCHEMBL3420534 0.78 MAOA (0.41) RAB9ALMNASMN1; SMN2ACP3HTR2A
Hydrochloric Acid SCHEMBL27782030 0.77 MAOA (0.40) RAB9ALMNASMN1; SMN2ACP3HTR2A
SCHEMBL23377295 0.77 MAOA (0.40) RAB9ALMNASMN1; SMN2ACP3HTR2A
SCHEMBL29955528 0.76 ALDH1A1 (0.42) ALDH1A1RAB9AKMT2ALMNAGAA
SCHEMBL23921624 0.75 HTR2A (0.43) ALDH1A1RAB9AKMT2ALMNAGAA
SCHEMBL660713 0.75 ALDH1A1 (0.44) ALDH1A1RAB9AKMT2ALMNAGAA

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
US-20250289830-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2025-09-18 US disclosed
US-12351591-B2 KRas inhibitors ELI LILLY AND COMPANY (US) 2025-07-08 US disclosed
EP-4499233-A1 KRAS INHIBITORS Eli Lilly and Company (US) 2025-02-05 EP disclosed
CN-119095853-A KRAS inhibitors 伊莱利利公司 2024-12-06 CN disclosed
US-20240043451-A1 KRAS INHIBITORS ELI LILLY AND COMPANY 2024-02-08 US disclosed
WO-2023183585-A1 KRAS INHIBITORS ELI LILLY AND COMPANY (US) 2023-09-28 WO 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 (3 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-20240043451-A1 KRAS INHIBITORS KRAS, NRAS, HRAS ALDH1A1 1852/4885RAB9A 36/4885KMT2A 652/4885
US-12351591-B2 KRas inhibitors KRAS, NRAS, HRAS ALDH1A1 1852/4885RAB9A 36/4885KMT2A 652/4885
US-20250289830-A1 KRAS INHIBITORS KRAS, NRAS, HRAS ALDH1A1 1852/4885RAB9A 36/4885KMT2A 652/4885

“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.