SCHEMBL30848437

SCHEMBL30848437

Cc1ccccc1C(=O)NCC1(F)CC1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 8/20 0.59
HCN1 O60741 1/20 0.57
HPGD P15428 6/20 0.54
SMN1; SMN2 Q16637 3/20 0.49
MAPK1 P28482 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 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
SCHEMBL30848473 0.81 MEN1 (0.64) P2RX7HCN1HPGDMEN1KMT2A
SCHEMBL13162647 0.80 P2RX7 (0.58) P2RX7HCN1HPGDSMN1; SMN2MAPK1
SCHEMBL13634515 0.80 P2RX7 (0.58) P2RX7HCN1HPGDSMN1; SMN2MAPK1
SCHEMBL13161950 0.79 P2RX7 (0.57) P2RX7HCN1HPGDSMN1; SMN2MAPK1
SCHEMBL13162929 0.79 HCN1 (0.62) P2RX7HCN1HPGD
SCHEMBL13634448 0.78 P2RX7 (0.56) P2RX7HCN1HPGDSMN1; SMN2MAPK1
SCHEMBL13162890 0.78 P2RX7 (0.56) P2RX7HCN1HPGDSMN1; SMN2MAPK1
SCHEMBL13161956 0.78 P2RX7 (0.56) P2RX7HCN1HPGDSMN1; SMN2MAPK1
SCHEMBL30848670 0.77 MEN1 (0.54) P2RX7HCN1HPGDMEN1KMT2A
SCHEMBL30848447 0.77 LMNA (0.59) P2RX7SMN1; SMN2MAPK1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118043327-A FGFR inhibitors and methods of use thereof 思康睿奇(上海)药业有限公司 2024-05-14 CN claimed
CN-118043327-A FGFR inhibitors and methods of use thereof 思康睿奇(上海)药业有限公司 2024-05-14 CN disclosed