SCHEMBL7510097

SCHEMBL7510097

O=C(c1ccc(-c2ccsc2)cc1Cl)c1cccc2c1Nc1ncccc1CN2

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 4/20 0.41
AVPR1A P37288 1/20 0.41
RORB Q92753 1/20 0.33
TRPM4 Q8TD43 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
CNR1 P21554 1/20 0.31
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
ACMSD Q8TDX5 1/20 0.31
P2RX3 P56373 1/20 0.31
CTSL P07711 1/20 0.30
CTSC P53634 1/20 0.30
PAK1 Q13153 1/20 0.30

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
SCHEMBL7451415 0.84 AVPR2 (0.39) AVPR2AVPR1ARORB
SCHEMBL7508188 0.82 IDH1 (0.39) AVPR2AVPR1ARORB
SCHEMBL6615566 0.81 AVPR2 (0.61) AVPR2AVPR1ARORBPAK1
SCHEMBL7505774 0.75 P2RX3 (0.34) AVPR2AVPR1AP2RX3
SCHEMBL6615080 0.74 KDM4E (0.38) AVPR2
SCHEMBL7392203 0.69 MAPT (0.36) AVPR2
SCHEMBL7390951 0.69 NPC1 (0.41)
SCHEMBL7396733 0.67 RAB9A (0.40)
SCHEMBL6616850 0.66 AVPR2 (0.62) AVPR2AVPR1A
SCHEMBL6616672 0.66 AVPR2 (0.49) AVPR2AVPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1149103-A1 THIENYLBENZOYLBENZAZEPINES AS VASOPRESSIN AGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-31 EP claimed
US-6297234-B1 Arylthiophene vasopressin agonists AMERICAN HOME PRODUCTS CORPORATION 2001-10-02 US claimed
US-6268360-B1 URINATION DELAY AMERICAN HOME PRODUCTS CORPORATION 2001-07-31 US claimed
WO-2000046227-A1 THIENYLBENZOYLBENZAZEPINES AS VASOPRESSIN AGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-08-10 WO claimed
EP-1149103-A1 THIENYLBENZOYLBENZAZEPINES AS VASOPRESSIN AGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 2001-10-31 EP disclosed
US-6297234-B1 Arylthiophene vasopressin agonists AMERICAN HOME PRODUCTS CORPORATION 2001-10-02 US disclosed
US-6268360-B1 URINATION DELAY AMERICAN HOME PRODUCTS CORPORATION 2001-07-31 US disclosed
WO-2000046227-A1 THIENYLBENZOYLBENZAZEPINES AS VASOPRESSIN AGONISTS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-08-10 WO disclosed