SCHEMBL4518783

SCHEMBL4518783

CCc1ccc(C2CN(C(=O)N(C)C)C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
MAPT P10636 1/20 0.46
STAT1 P42224 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
F2R P25116 9/20 0.44
S1PR1 P21453 1/20 0.42
S1PR5 Q9H228 1/20 0.42
CSF1R P07333 2/20 0.42
USP30 Q70CQ3 1/20 0.40
PDE4B Q07343 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL24478307 0.85 MAPT (0.50) RAB9ANPC1MAPTSTAT1SMN1; SMN2
SCHEMBL10265073 0.82 NPC1 (0.49) RAB9ANPC1MAPTSTAT1SMN1; SMN2
SCHEMBL16994755 0.82 KMT2A (0.48) RAB9ANPC1MAPTSMN1; SMN2USP30
SCHEMBL10265353 0.81 NPC1 (0.48) RAB9ANPC1MAPTSTAT1SMN1; SMN2
SCHEMBL4409348 0.78 MEN1 (0.50) RAB9ANPC1MAPTSMN1; SMN2USP30
SCHEMBL640841 0.76 F2R (0.48) RAB9ANPC1MAPTSTAT1SMN1; SMN2
SCHEMBL4508468 0.76 F2R (0.51) RAB9ANPC1MAPTSTAT1SMN1; SMN2
SCHEMBL640228 0.75 F2R (0.50) RAB9ANPC1MAPTSTAT1SMN1; SMN2
SCHEMBL1580717 0.74 F2R (0.50) RAB9ANPC1MAPTSTAT1SMN1; SMN2
SCHEMBL20884575 0.72 MAPT (0.56) MAPTSMN1; SMN2KMT2A

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-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-03 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-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK RAB9A 2487/4885NPC1 949/4885MAPT 4633/4885

“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.