SCHEMBL20465147

SCHEMBL20465147

CCn1c(Cc2ccc(C)cc2)cc2cc(C(=O)O)ccc21

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 1/20 0.48
KMT2A Q03164 3/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
THRB P10828 1/20 0.46
HPGD P15428 1/20 0.46
RORC P51449 5/20 0.43
ALDH1A1 P00352 3/20 0.43
GPR35 Q9HC97 2/20 0.41
IDH1 O75874 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL18440704 0.89 RORC (0.53) KMT2ARAB9AMAPTKDM4EMEN1
SCHEMBL20465143 0.86 MAPT (0.48) KMT2ARAB9AMAPTKDM4EMEN1
SCHEMBL18440701 0.85 RORC (0.55) SRD5A2KMT2ARORCALDH1A1IDH1
SCHEMBL20465183 0.83 RORC (0.42) KMT2ARAB9AMAPTKDM4EMEN1
SCHEMBL19360604 0.83 IDH1 (0.47) RORCIDH1
SCHEMBL20465180 0.79 IDH1 (0.48) SRD5A2RORCALDH1A1IDH1SMN1; SMN2
SCHEMBL19360401 0.79 RORC (0.51) RORC
SCHEMBL19360349 0.78 RORC (0.68) RORC
SCHEMBL14549402 0.78 KMT2A (0.51) KMT2ARAB9AMAPTKDM4EMEN1
SCHEMBL18440697 0.77 RORC (0.50) KMT2ARAB9AMAPTKDM4EMEN1

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-20180222860-A1 MODULATORS OF ROR-GAMMA VITAE PHARMACEUTICALS, LLC 2018-08-09 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-20180222860-A1 MODULATORS OF ROR-GAMMA RORB, RORC, RORA SRD5A2 144/4885KMT2A 2604/4885RAB9A 714/4885

“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.