SCHEMBL7041969

SCHEMBL7041969

CC(C)=CCN(c1ccc(OCc2ccc(Cl)cc2)cc1)[C@H]1CCN(C(=O)C(N)CC(C)C)C1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 15/20 0.77
DPP7 Q9UHL4 1/20 0.38
HTR2A P28223 1/20 0.38
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL7041973 1.00 CACNA1B (0.77) CACNA1BDPP7HTR2ANPC1ALDH1A1
SCHEMBL7041967 1.00 CACNA1B (0.77) CACNA1BDPP7HTR2ANPC1ALDH1A1
SCHEMBL7038248 0.95 CACNA1B (0.70) CACNA1BDPP7NPC1ALDH1A1MAPT
SCHEMBL7038247 0.95 CACNA1B (0.70) CACNA1BDPP7NPC1ALDH1A1MAPT
SCHEMBL7038253 0.95 CACNA1B (0.70) CACNA1BDPP7NPC1ALDH1A1MAPT
SCHEMBL7043628 0.95 CACNA1B (0.85) CACNA1BDPP7
SCHEMBL7043624 0.95 CACNA1B (0.85) CACNA1BDPP7
SCHEMBL7043534 0.90 CACNA1B (0.61) CACNA1BDPP7
SCHEMBL7043529 0.90 CACNA1B (0.61) CACNA1BDPP7
SCHEMBL7043531 0.90 CACNA1B (0.61) CACNA1BDPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030060632-A1 Calcium channel blockers HU LAIN-YEN (US) 2003-03-27 US claimed
US-20010023249-A1 Calcium channel blockers HU LAIN-YEN (US) 2001-09-20 US claimed
WO-1999007689-A1 ANILINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1999-02-18 WO claimed
US-20030060632-A1 Calcium channel blockers HU LAIN-YEN (US) 2003-03-27 US disclosed
US-6495715-B2 STROKE, ANTIISCHEMIC AGENTS, TRAUMAS, ANTIEPILEPIC AGENTS WARNER-LAMBERT COMPANY 2002-12-17 US disclosed
US-20010023249-A1 Calcium channel blockers HU LAIN-YEN (US) 2001-09-20 US disclosed
WO-1999007689-A1 ANILINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS WARNER-LAMBERT COMPANY (US) 1999-02-18 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 (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-20010023249-A1 Calcium channel blockers CACNA1I, CACNA1B, CACNA1G CACNA1B 2/4885DPP7 3370/4885HTR2A 1573/4885
US-20030060632-A1 Calcium channel blockers CACNA1I, CACNA1B, CACNA1G CACNA1B 2/4885DPP7 3370/4885HTR2A 1573/4885

“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.