SCHEMBL30009239

SCHEMBL30009239

CC1C=CCN(C(=O)c2ccc(F)cc2Cl)C1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 9/20 0.51
NPC1 O15118 1/20 0.51
HSD11B1 P28845 1/20 0.50
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HPGD P15428 3/20 0.45
TSHR P16473 1/20 0.43
JAK1 P23458 1/20 0.43
UBE2M P61081 1/20 0.42
DCUN1D1 Q96GG9 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL30008761 0.75 AKR1C4 (0.43) ALDH1A1MEN1KMT2AHPGDTSHR
SCHEMBL30810022 0.74 P2RX7 (0.54) P2RX7NPC1HSD11B1ALDH1A1MEN1
SCHEMBL30691934 0.74 P2RX7 (0.54) P2RX7NPC1HSD11B1ALDH1A1MEN1
SCHEMBL30009357 0.74 TSHR (0.38) ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL31454276 0.74 P2RX7 (0.54) P2RX7NPC1HSD11B1ALDH1A1MEN1
SCHEMBL30009295 0.74 JAK1 (0.43) NPC1ALDH1A1HPGDTSHRJAK1
SCHEMBL31646988 0.72 HSD11B1 (0.56) P2RX7NPC1HSD11B1ALDH1A1MEN1
SCHEMBL31454267 0.72 HSD11B1 (0.56) P2RX7NPC1HSD11B1ALDH1A1MEN1
SCHEMBL30009886 0.70 JAK1 (0.39) NPC1ALDH1A1MEN1KMT2AHPGD
SCHEMBL30009910 0.70 JAK1 (0.40) NPC1HSD11B1ALDH1A1MEN1KMT2A

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
US-11524968-B2 Heterocyclic compound as a protein kinase inhibitor HK INNO.N CORPORATION (KR) 2022-12-13 US 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-11524968-B2 Heterocyclic compound as a protein kinase inhibitor MAP3K20, MAP3K15, MAP3K1 P2RX7 3396/4885NPC1 1715/4885HSD11B1 1531/4885

“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.