SCHEMBL1481072

SCHEMBL1481072

CCn1cc(-c2ccc(Cl)cc2Cl)nc1/C=C/c1ccc(-c2ccc(OCCCC(=O)OC)cc2)cc1F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
PDE3B Q13370 7/20 0.38
PDE3A Q14432 7/20 0.38
P2RY12 Q9H244 6/20 0.38
PDE2A O00408 2/20 0.37
CNR1 P21554 4/20 0.37
DHODH Q02127 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
FFAR1 O14842 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
PABPC1 P11940 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL1481076 1.00 MAPT (0.39) MAPTPDE3BPDE3AP2RY12PDE2A
SCHEMBL1480691 0.95 MAPT (0.39) MAPTPDE3BPDE3AP2RY12PDE2A
SCHEMBL1480693 0.95 MAPT (0.39) MAPTPDE3BPDE3AP2RY12PDE2A
SCHEMBL1481004 0.93 MAPT (0.38) MAPTPDE3BPDE3AP2RY12PDE2A
SCHEMBL1481006 0.93 MAPT (0.38) MAPTPDE3BPDE3AP2RY12PDE2A
SCHEMBL1481872 0.93 FFAR4 (0.42) PDE3BPDE3AP2RY12CNR1DHODH
SCHEMBL1481871 0.93 FFAR4 (0.42) PDE3BPDE3AP2RY12CNR1DHODH
SCHEMBL12754214 0.90 MAPT (0.43) MAPTPDE3BPDE3AP2RY12PDE2A
SCHEMBL1481218 0.90 MAPT (0.42) MAPTPDE3BPDE3AP2RY12PDE2A
SCHEMBL1481219 0.90 MAPT (0.42) MAPTPDE3BPDE3AP2RY12PDE2A

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-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents TRANSTECH PHARMA, INC. (US) 2011-03-31 US disclosed
US-20040192743-A1 Substituted azole derivatives as therapeutic agents TRANSTECH PHARMA, INC. 2004-09-30 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 (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-20040192743-A1 Substituted azole derivatives as therapeutic agents PTPRS, PTPRO, PTPRJ MAPT 3558/4885PDE3B 183/4885PDE3A 272/4885
US-20110077399-A1 Substituted Azole Derivatives as Therapeutic Agents PTPRS, PTPRO, PTPRJ MAPT 3558/4885PDE3B 183/4885PDE3A 272/4885

“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.