SCHEMBL29933914

SCHEMBL29933914

O=C(N[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.64
RAB9A P51151 2/20 0.64
SSTR3 P32745 9/20 0.63
HDAC4 P56524 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
CNR1 P21554 1/20 0.54
TRPA1 O75762 1/20 0.53
NAMPT P43490 2/20 0.51
DGAT2 Q96PD7 2/20 0.50
TAS1R3 Q7RTX0 1/20 0.50
TAS1R1 Q7RTX1 1/20 0.50
TAS1R2 Q8TE23 1/20 0.50

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
SCHEMBL29933088 0.84 RAB9A (0.64) NPC1RAB9ASSTR3HDAC4HDAC6
SCHEMBL14117665 0.84 HDAC4 (0.52) NPC1RAB9ASSTR3HDAC4HDAC6
SCHEMBL31359373 0.84 F10 (0.56) HDAC4HDAC6CNR1TAS1R3TAS1R1
SCHEMBL7348185 0.83 NPSR1 (0.58) NPC1RAB9ASSTR3HDAC4HDAC6
SCHEMBL13495007 0.83 NPSR1 (0.58) NPC1RAB9ASSTR3HDAC4HDAC6
SCHEMBL7348191 0.83 NPSR1 (0.58) NPC1RAB9ASSTR3HDAC4HDAC6
SCHEMBL8740548 0.83 NPSR1 (0.58) NPC1RAB9ASSTR3HDAC4HDAC6
SCHEMBL7348189 0.83 NPSR1 (0.58) NPC1RAB9ASSTR3HDAC4HDAC6
SCHEMBL8740547 0.83 NPSR1 (0.58) NPC1RAB9ASSTR3HDAC4HDAC6
SCHEMBL28310450 0.83 NPC1 (0.62) NPC1RAB9ASSTR3HDAC4TRPA1

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-12509424-B2 Compound and composition as PDGF receptor kinase inhibitor NIPPON SHINYAKU CO., LTD. (JP) 2025-12-30 US disclosed
US-20230101484-A1 COMPOUND AND COMPOSITION AS PDGF RECEPTOR KINASE INHIBITOR NIPPON SHINYAKU CO., LTD. (JP) 2023-03-30 US disclosed
CN-115315421-A Compounds and compositions as PDGF receptor kinase inhibitors 日本新药株式会社 2022-11-08 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-12509424-B2 Compound and composition as PDGF receptor kinase inhibitor PDGFRA, PDGFRB, PDGFA NPC1 4118/4885RAB9A 2815/4885SSTR3 1326/4885
US-20230101484-A1 COMPOUND AND COMPOSITION AS PDGF RECEPTOR KINASE INHIBITOR PDGFRB, PDGFRA, PDGFA NPC1 4509/4885RAB9A 2531/4885SSTR3 347/4885

“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.