SCHEMBL16178191

SCHEMBL16178191

Cc1cc(N2CCN(C(=O)O)CC2)ncc1N

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMO Q99835 14/20 0.43
OPRM1 P35372 1/20 0.41
OPRL1 P41146 1/20 0.41
UHRF1 Q96T88 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL17977039 0.85 SMO (0.43) SMOCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL3174430 0.85 SMO (0.55) SMOOPRM1OPRL1CYP1A2CYP2C9
SCHEMBL3392057 0.82 OPRM1 (0.40) SMOOPRM1OPRL1CYP1A2CYP2C9
SCHEMBL14938608 0.81 MAP4K4 (0.52) MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL14938526 0.80 HTR3A (0.53) UHRF1CYP1A2KMT2A
SCHEMBL29464176 0.80 HTR3A (0.53) UHRF1CYP1A2KMT2A
SCHEMBL1100741 0.79 UHRF1 (0.48) UHRF1CYP1A2CYP2C9CYP2C19MEN1
SCHEMBL30298014 0.79 UHRF1 (0.48) OPRM1OPRL1UHRF1CYP1A2CYP2C9
SCHEMBL16178365 0.78 ALDH1A1 (0.66) SMOCYP1A2CYP2C9CYP2C19MEN1
SCHEMBL16178366 0.78 ALDH1A1 (0.66) SMOCYP1A2CYP2C9CYP2C19MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096614-B2 Therapeutically active thiazolo-pyrimidine derivatives UCB PHARMA SA (BE) 2015-08-04 US disclosed
US-20140315885-A1 Therapeutically Active Thiazolo-Pyrimidine Derivatives UCB PHARMA SA (BE) 2014-10-23 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-20140315885-A1 Therapeutically Active Thiazolo-Pyrimidine Derivatives TPMT, IFNG, IRF3 SMO 2545/4885OPRM1 4282/4885OPRL1 4074/4885

“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.