SCHEMBL24567459

SCHEMBL24567459

CN1CCC(C(C)(C)C2CCN(CC(F)(F)F)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.33
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
NCF1 P14598 1/20 0.32
HPGDS O60760 1/20 0.30
GPR119 Q8TDV5 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
SCHEMBL13713266 0.82 GNAI3 (0.47) KDM1AGNAI3GNAO1GNAI1NCF1
SCHEMBL10221907 0.80 MGAT2 (0.37) KDM1AHPGDSGPR119
SCHEMBL2740581 0.75 HTT (0.40)
SCHEMBL13713265 0.74 ALDH1A1 (0.42) KDM1ANCF1
SCHEMBL25025562 0.74 KDM1A (0.33) KDM1AHPGDSGPR119
SCHEMBL19223404 0.73 MGAT2 (0.33) KDM1A
SCHEMBL19223408 0.73 MGAT2 (0.33) KDM1A
SCHEMBL18133863 0.73 MGAT2 (0.33) KDM1A
SCHEMBL25024519 0.73 KDM1A (0.33) KDM1AHPGDSGPR119
SCHEMBL25025564 0.73 KDM1A (0.33) KDM1AHPGDSGPR119

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-3781563-B1 HPK1 INHIBITORS, PREPARATION METHOD AND APPLICATION THEREOF ZHUHAI YUFAN BIOTECHNOLOGIES CO LTD (CN) 2022-06-29 EP disclosed