SCHEMBL30958932

SCHEMBL30958932

CCOC(=O)[C@]12CNC[C@@]1(C(F)(F)F)C2

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
OPRM1 P35372 2/20 0.33
TP53 P04637 1/20 0.32
ATM Q13315 1/20 0.32
BRD4 O60885 1/20 0.31
OPRD1 P41143 1/20 0.30
OPRK1 P41145 1/20 0.30
KMT2A Q03164 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL30958933 1.00 POLB (0.40) POLBSLC6A2SLC6A4SLC6A3OPRM1
SCHEMBL26928887 1.00 POLB (0.40) POLBSLC6A2SLC6A4SLC6A3OPRM1
SCHEMBL31575285 0.82 LMNA (0.34)
SCHEMBL28851425 0.78 POLB (0.45) POLBSLC6A2SLC6A4SLC6A3OPRM1
Hydrochloric Acid SCHEMBL15414875 0.77 POLB (0.44) POLBSLC6A2SLC6A4SLC6A3OPRM1
SCHEMBL30543683 0.74
SCHEMBL29877171 0.73 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL29876777 0.71 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL13957860 0.70 SLC6A4 (0.41) POLBSLC6A2SLC6A4SLC6A3OPRM1
SCHEMBL31575279 0.69 DGAT1 (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4624455-A1 PREPARATION METHOD FOR CHIRAL PYRROLE DERIVATIVE AND INTERMEDIATE THEREOF Kangbaida (Sichuan) Biotechnology Co., Ltd. (CN) 2025-10-01 EP disclosed
US-20250276986-A1 PREPARATION METHOD FOR CHIRAL PYRROLE DERIVATIVE AND INTERMEDIATE THEREOF Kangbaida (Sichuan) Biotechnology Co., Ltd (CN) 2025-09-04 US disclosed
WO-2024109801-A1 PREPARATION METHOD FOR CHIRAL PYRROLE DERIVATIVE AND INTERMEDIATE THEREOF 成都百裕制药股份有限公司 2024-05-30 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 (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-20250276986-A1 PREPARATION METHOD FOR CHIRAL PYRROLE DERIVATIVE AND INTERMEDIATE THEREOF PIN1, DHPS, PPOX POLB 1288/4885SLC6A2 4218/4885SLC6A4 2562/4885

“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.