SCHEMBL29500951

SCHEMBL29500951

CN1Cc2cc(Cl)ccc2-n2c(nnc2C2CCN(c3ccccn3)CC2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 16/20 1.00
AVPR2 P30518 8/20 1.00
KCNH2 Q12809 5/20 1.00
OXTR P30559 2/20 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
SCHEMBL5095191 1.00 AVPR1A (1.00) AVPR1AAVPR2KCNH2OXTR
Hydrochloric Acid SCHEMBL5102018 0.99 AVPR1A (0.98) AVPR1AAVPR2KCNH2OXTR
SCHEMBL5098355 0.93 AVPR1A (0.86) AVPR1AAVPR2KCNH2OXTR
SCHEMBL5094840 0.93 AVPR1A (0.86) AVPR1AAVPR2KCNH2OXTR
SCHEMBL5108491 0.89 AVPR1A (0.81) AVPR1AAVPR2KCNH2OXTR
SCHEMBL5107939 0.89 AVPR1A (0.81) AVPR1AAVPR2KCNH2
SCHEMBL5101519 0.89 AVPR1A (0.80) AVPR1AAVPR2KCNH2OXTR
SCHEMBL20727308 0.89 AVPR1A (0.80) AVPR1AAVPR2KCNH2
SCHEMBL8325451 0.89 AVPR1A (0.79) AVPR1AAVPR2KCNH2OXTR
SCHEMBL5098204 0.88 AVPR1A (1.00) AVPR1AAVPR2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12247037-B2 1-(2,6-diazaspiro[3.3]heptan-6-yl)-5,6-dihydro-4h-benzo[f][1,2,4]triazolo[4,3-A][1,4]diazepine derivatives and related compounds as vasopressin antagonists for the treatment of neuro-psychological disorders Neumora Therapeutics, Inc. (US) 2025-03-11 US disclosed
US-12152038-B2 Vasopressin receptor antagonists and products and methods related thereto Neumora Therapeutics, Inc. (US) 2024-11-26 US disclosed
CN-118108723-A Triazolobenzodiazepine compound and preparation method and application thereof 暨南大学附属第一医院(广州华侨医院) 2024-05-31 CN disclosed
EP-3894414-B1 1-(2,6-DIAZASPIRO[3.3]HEPTAN-6-YL)-5,6-DIHYDRO-4H-BENZO[F][1,2,4]TRIAZOLO[4,3-A][1,4]DIAZEPINE DERIVATIVES AS VASOPRESSIN ANTAGONISTS FOR THE TREATMENT OF NEURO-PSYCHOLOGICAL DISORDERS NEUMORA THERAPEUTICS INC (US) 2024-04-10 EP disclosed
US-11858943-B2 Vasopressin receptor antagonists and products and methods related thereto Neumora Therapeutics, Inc. (US) 2024-01-02 US disclosed
EP-3679043-B9 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO NEUMORA THERAPEUTICS INC (US) 2023-09-27 EP disclosed
EP-3679043-B1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO NEUMORA THERAPEUTICS INC (US) 2023-05-31 EP disclosed
US-20230093235-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO Neumora Therapeutics, Inc. 2023-03-23 US disclosed
CN-111479813-B Triazolobenzazepines as vasopressin V1A receptor antagonists 吉瑞工厂 2023-03-21 CN disclosed
US-20230084719-A1 1-(2,6-DIAZASPIRO[3.3]HEPTAN-6-YL)-5,6-DIHYDRO-4H-BENZO[F][1,2,4]TRIAZOLO[4,3-A][1,4]DIAZEPINE DERIVATIVES AND RELATED COMPOUNDS AS VASOPRESSIN ANTAGONISTS FOR THE TREATMENT OF NEURO-PSYCHOLOGICAL DISORDERS BLACKTHORN THERAPEUTICS, INC. 2023-03-16 US disclosed
CN-111212842-B Vasopressin receptor antagonists and products and methods related thereto 布莱克索恩治疗公司 2022-10-25 CN disclosed
EP-3724192-B1 TRIAZOLOBENZAZEPINES AS VASOPRESSIN V1A RECEPTOR ANTAGONISTS RICHTER GEDEON NYRT (HU) 2022-08-03 EP disclosed
US-11298363-B2 Triazolobenzazepines as vasopressin V1a receptor antagonists RICHTER GEDEON NYRT. (HU) 2022-04-12 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 (6 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-12152038-B2 Vasopressin receptor antagonists and products and methods related thereto AVPR1A, AVPR2, AVPR1B AVPR1A 1/4885AVPR2 2/4885KCNH2 482/4885
US-11298363-B2 Triazolobenzazepines as vasopressin V1a receptor antagonists AVPR1B, AVPR1A, AVPR2 AVPR1A 2/4885AVPR2 3/4885KCNH2 413/4885
US-11858943-B2 Vasopressin receptor antagonists and products and methods related thereto AVPR1B, AVPR1A, AVPR2 AVPR1A 2/4885AVPR2 3/4885KCNH2 635/4885
US-12247037-B2 1-(2,6-diazaspiro[3.3]heptan-6-yl)-5,6-dihydro-4h-benzo[f][1,2,4]triazolo[4,3-A][1,4]diazepine derivatives and related compounds as vasopressin antagonists for the treatment of neuro-psychological disorders AVPR1B, AVPR1A, AVPR2 AVPR1A 2/4885AVPR2 3/4885KCNH2 968/4885
US-20230093235-A1 VASOPRESSIN RECEPTOR ANTAGONISTS AND PRODUCTS AND METHODS RELATED THERETO AVPR1B, AVPR1A, AVPR2 AVPR1A 2/4885AVPR2 3/4885KCNH2 635/4885
US-20230084719-A1 1-(2,6-DIAZASPIRO[3.3]HEPTAN-6-YL)-5,6-DIHYDRO-4H-BENZO[F][1,2,4]TRIAZOLO[4,3-A][1,4]DIAZEPINE DERIVATIVES AND RELATED COMPOUNDS AS VASOPRESSIN ANTAGONISTS FOR THE TREATMENT OF NEURO-PSYCHOLOGICAL DISORDERS AVPR1B, AVPR1A, AVPR2 AVPR1A 2/4885AVPR2 3/4885KCNH2 539/4885

“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.