SCHEMBL6792992

SCHEMBL6792992

CCC1=C(C(=O)OCc2ccccc2)C(c2ccc(F)c(F)c2)N(C(=O)OC)C(OC)=N1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE1C Q14123 1/20 0.45
MAPT P10636 1/20 0.38
ADRA1A P35348 15/20 0.37
ADRA1D P25100 14/20 0.37
ADRA1B P35368 14/20 0.37
POLB P06746 1/20 0.36
OPRM1 P35372 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35

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
SCHEMBL6712135 0.88 PDE1C (0.39) PDE1CMAPTADRA1AADRA1DADRA1B
SCHEMBL6196607 0.81 ADRA1D (0.49) PDE1CMAPTADRA1AADRA1DADRA1B
SCHEMBL7978679 0.79 PDE1C (0.39) PDE1CMAPTADRA1AADRA1DADRA1B
SCHEMBL6195857 0.76 TSHR (0.46)
SCHEMBL6685710 0.75 ROCK2 (0.38) ADRA1AADRA1DADRA1BOPRM1
SCHEMBL6646229 0.74 ADRA1D (0.39) ADRA1AADRA1DADRA1B
SCHEMBL6787375 0.72 PDE1C (0.37) PDE1CMAPT
SCHEMBL6715274 0.71 BCL9 (0.35) MAPTADRA1AADRA1DADRA1B
SCHEMBL6715281 0.71 BCL9 (0.35) MAPTADRA1AADRA1DADRA1B
SCHEMBL8322878 0.71 PDE1C (0.38) PDE1CMAPTADRA1AADRA1DADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727257-B1 HYPOTENSIVE AGENTS FOR INTRAOCULAR PRESSURE; ANTICHOLESTEROL AGENTS; RELAXING URINARY TRACT TISSUE; BENIGN PROSTATIC HYPERPLASIA, IMPOTENCY, AND CARDIOVASCULAR DISORDERS; ANTIARRHYTHMIA AGENTS SYNAPTIC PHARMACEUTICAL CORPORATION 2004-04-27 US disclosed
US-20020010186-A1 Dihydropyrimidines and uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2002-01-24 US disclosed
US-6268369-B1 ALPHA SUB 1 INHIBITORS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-07-31 US disclosed
US-6245773-B1 BENIGN PROSTATIC HYPERPLAMIA; REDUCTION OF INTRAOCULAR PRESSURE SYNAPTIC PHARMACEUTICAL CORPORATION 2001-06-12 US disclosed
WO-1998051311-A2 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-11-19 WO disclosed
WO-1996014846-A1 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1996-05-23 WO 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-20020010186-A1 Dihydropyrimidines and uses thereof QDPR, DPYD, ADRA1D PDE1C 50/4885MAPT 2100/4885ADRA1A 4/4885

“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.