SCHEMBL31339766

SCHEMBL31339766

Cn1c(-c2ccncc2F)nc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
ATM Q13315 1/20 0.52
NPC1 O15118 7/20 0.50
RAB9A P51151 7/20 0.50
TP53 P04637 5/20 0.50
MAPT P10636 3/20 0.50
CASP1 P29466 1/20 0.50
KDM4E B2RXH2 7/20 0.47
ALDH1A1 P00352 7/20 0.47
PKM P14618 4/20 0.47
HSD17B10 Q99714 3/20 0.47
GAA P10253 2/20 0.47
ALOX15 P16050 1/20 0.47
SMN1; SMN2 Q16637 6/20 0.46
CYP11B2 P19099 2/20 0.46
POLB P06746 1/20 0.46
CYP11B1 P15538 1/20 0.46
HPGD P15428 3/20 0.46
LMNA P02545 2/20 0.46

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
SCHEMBL10249024 0.83 SMN1; SMN2 (0.47) MEN1KMT2AATMNPC1RAB9A
SCHEMBL3714642 0.83 PDE10A (0.56) MEN1KMT2AATMNPC1RAB9A
SCHEMBL429041 0.82 MEN1 (0.51) MEN1KMT2AATMNPC1RAB9A
SCHEMBL13515552 0.82 ATM (0.49) MEN1KMT2AATMNPC1RAB9A
SCHEMBL17896693 0.81 PDE10A (0.50) MEN1KMT2ARAB9AMAPTKDM4E
SCHEMBL10176223 0.81 SMN1; SMN2 (0.50) MEN1KMT2AATMNPC1RAB9A
SCHEMBL17896660 0.79 CYP11B2 (0.43) ATMNPC1RAB9ATP53MAPT
SCHEMBL167106 0.79 PDE10A (0.46) ATMSMN1; SMN2CYP11B2POLBCYP11B1
SCHEMBL17896744 0.78 CYP11B2 (0.47) ATMNPC1RAB9ATP53MAPT
SCHEMBL10175104 0.78 CYP11B2 (0.45) SMN1; SMN2CYP11B2POLBCYP11B1KDR

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
CN-119365192-A Heteroaryl compounds as HPK1 inhibitors and methods of use thereof 深圳市原力深湾创新药有限公司 2025-01-24 CN disclosed