SCHEMBL27009296

SCHEMBL27009296

O[C@@H]1CCN(c2ccc(Br)cc2F)C1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.39
HPGD P15428 3/20 0.39
ALDH1A1 P00352 2/20 0.39
NOTUM Q6P988 1/20 0.39
PDE7A Q13946 1/20 0.38
RAD52 P43351 1/20 0.38
GAA P10253 2/20 0.38
CCR1 P32246 4/20 0.38
CCR2 P41597 4/20 0.38
CHEK1 O14757 1/20 0.38
TSHR P16473 2/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.37
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
AR P10275 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL27009114 1.00 F10 (0.39) F10HPGDALDH1A1NOTUMPDE7A
SCHEMBL853351 0.81 ALDH1A1 (0.51) F10HPGDALDH1A1NOTUMPDE7A
SCHEMBL27004866 0.81 ACACB (0.47) F10HPGDALDH1A1NOTUMPDE7A
SCHEMBL31481131 0.81 ALDH1A1 (0.51) F10HPGDALDH1A1NOTUMPDE7A
SCHEMBL13957107 0.81 KDM4E (0.40) HPGDALDH1A1RAD52GAACHEK1
SCHEMBL426972 0.79 AR (0.53) HPGDALDH1A1RAD52CHEK1LMNA
SCHEMBL6103929 0.79 ERN1 (0.44) HPGDALDH1A1NOTUMRAD52CHEK1
SCHEMBL1410645 0.79 LMNA (0.55) ALDH1A1MAPTLMNAPDE3BPDE3A
SCHEMBL21590278 0.78 PBRM1 (0.40) ALDH1A1RAD52GAACHEK1MAPT
SCHEMBL21590152 0.78 PBRM1 (0.40) ALDH1A1RAD52GAACHEK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4306520-A1 THIOPHENE COMPOUND AND APPLICATION THEREOF Medshine Discovery Inc. (CN) 2024-01-17 EP disclosed