SCHEMBL30520344

SCHEMBL30520344

CC(C)Oc1ccc(CNc2cccnc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.64
KDM4C Q9H3R0 1/20 0.55
POLB P06746 2/20 0.53
HPGD P15428 1/20 0.53
LTA4H P09960 1/20 0.53
F2 P00734 1/20 0.52
PRSS1 P07477 1/20 0.52
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALDH1A1 P00352 2/20 0.49
PDE4B Q07343 1/20 0.48
NAMPT P43490 1/20 0.47
KMT2A Q03164 1/20 0.46
HTT P42858 1/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
TP53 P04637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL25414303 1.00 RAB9A (0.64) RAB9AKDM4CPOLBHPGDLTA4H
SCHEMBL19198550 0.84 RAB9A (0.69) RAB9APOLBLTA4HLMNAGAA
SCHEMBL19223057 0.83 PPARG (0.60) RAB9AKDM4CLTA4HF2PRSS1
SCHEMBL10054992 0.83 RAB9A (0.83) RAB9ALTA4HALDH1A1PDE4BKMT2A
SCHEMBL19198137 0.79 RAB9A (0.63) RAB9AKDM4CLTA4HF2LMNA
SCHEMBL30520217 0.79 RAB9A (0.63) RAB9AKDM4CLTA4HF2LMNA
SCHEMBL19198628 0.79 RAB9A (1.00) RAB9APOLBHPGDLTA4HGAA
SCHEMBL4805011 0.76 LTA4H (0.79) RAB9AHPGDLTA4HALDH1A1KMT2A
SCHEMBL11080159 0.76 RAB9A (0.58) RAB9APOLBLTA4HF2SMN1; SMN2
SCHEMBL11078808 0.76 SMN1; SMN2 (0.60) RAB9APOLBLMNASMN1; SMN2ALDH1A1

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-20230286917-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2023-09-14 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-20230286917-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5A, KDM1A RAB9A 3032/4885KDM4C 18/4885POLB 2023/4885

“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.