SCHEMBL28622798

SCHEMBL28622798

C[C@H](CCN)NC(=O)c1ccc2c(-c3ccc(C(F)(F)F)cc3)cccc2c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
NPSR1 Q6W5P4 1/20 0.42
HDAC6 Q9UBN7 3/20 0.41
HDAC4 P56524 2/20 0.41
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
TRPV1 Q8NER1 2/20 0.41
ALOX5AP P20292 2/20 0.41
FEN1 P39748 2/20 0.41
HDAC8 Q9BY41 1/20 0.40
SCN5A Q14524 2/20 0.39
SCN9A Q15858 2/20 0.39
MCHR1 Q99705 1/20 0.39
MTTP P55157 2/20 0.39
MLYCD O95822 1/20 0.39
PIN1 Q13526 1/20 0.39

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
SCHEMBL28640207 1.00 LMNA (0.45) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL23796399 1.00 LMNA (0.45) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL28922738 0.92 LMNA (0.47) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL23796438 0.92 LMNA (0.47) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL28624302 0.92 LMNA (0.47) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL23796082 0.92 NPC1 (0.45) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL23796204 0.92 NPC1 (0.45) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL23796081 0.92 NPC1 (0.45) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL23796144 0.90 HDAC6 (0.52) LMNANPC1RAB9ANPSR1HDAC6
SCHEMBL23796142 0.90 HDAC6 (0.52) LMNANPC1RAB9ANPSR1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11866431-B2 Bicyclic compounds VIVACE THERAPEUTICS, INC. (US) 2024-01-09 US disclosed
US-20230061429-A1 BICYCLIC COMPOUNDS VIVACE THERAPEUTICS, INC. 2023-03-02 US disclosed
CN-113302175-A Bicyclic compounds 维瓦斯治疗公司 2021-08-24 CN 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 (2 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-11866431-B2 Bicyclic compounds YAP1, MYC, TEAD2 LMNA 1925/4885NPC1 1261/4885RAB9A 1065/4885
US-20230061429-A1 BICYCLIC COMPOUNDS YAP1, MYC, TEAD2 LMNA 1925/4885NPC1 1261/4885RAB9A 1065/4885

“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.