SCHEMBL7437270

SCHEMBL7437270

Cn1ccc2cc(C(=O)N3Cc4cccn4Cc4ccccc43)ccc21

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 10/20 0.62
AVPR2 P30518 8/20 0.62

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
SCHEMBL6624843 0.79 AVPR1A (0.77) AVPR1AAVPR2
SCHEMBL13403212 0.79 AVPR1A (0.85) AVPR1AAVPR2
SCHEMBL5118260 0.78 AVPR1A (0.67) AVPR1AAVPR2
SCHEMBL3553365 0.78 AVPR1A (0.67) AVPR1AAVPR2
SCHEMBL7338770 0.78 AVPR1A (0.67) AVPR1AAVPR2
SCHEMBL7332293 0.78 AVPR1A (0.83) AVPR1AAVPR2
SCHEMBL2938052 0.77 AVPR1A (0.66) AVPR1AAVPR2
SCHEMBL3535343 0.77 AVPR1A (0.78) AVPR1AAVPR2
SCHEMBL6068819 0.77 AVPR1A (0.77) AVPR1AAVPR2
SCHEMBL5738429 0.77 AVPR1A (0.77) AVPR1AAVPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1149104-B1 PYRROLOBENZODIAZEPINE CARBOXYAMIDE VASOPRESSIN AGONISTS WYETH CORP (US) 2002-12-11 EP claimed
US-6344451-B1 DIABETES INSIPIDUS, NOCTURNAL ENURESIS, NOCTURIA, URINARY INCONTINENCE, BLEEDING AND COAGULATION DISORDERS, OR TEMPORARY DELAY OF URINATION AMERICAN HOME PRODUCTS 2002-02-05 US claimed
EP-1149104-B1 PYRROLOBENZODIAZEPINE CARBOXYAMIDE VASOPRESSIN AGONISTS WYETH CORP (US) 2002-12-11 EP disclosed
US-6344451-B1 DIABETES INSIPIDUS, NOCTURNAL ENURESIS, NOCTURIA, URINARY INCONTINENCE, BLEEDING AND COAGULATION DISORDERS, OR TEMPORARY DELAY OF URINATION AMERICAN HOME PRODUCTS 2002-02-05 US disclosed