SCHEMBL9577346

SCHEMBL9577346

CC(C)c1cccc(C(C)C)c1C(C)C.N=C=O.N=C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRB2 P47870 2/20 0.44
LMNA P02545 2/20 0.44
FAAH O00519 2/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
GABRB1 P18505 1/20 0.44
PTGS1 P23219 1/20 0.44
SLC6A2 P23975 1/20 0.44
HTR2C P28335 1/20 0.44
GABRA5 P31644 1/20 0.44
GABRA3 P34903 1/20 0.44
HTR2B P41595 1/20 0.44
GABRA2 P47869 1/20 0.44

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
Carbimide SCHEMBL7933850 0.91 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL29160572 0.88 GABRA1 (0.39) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL66227 0.85 GABRA1 (0.57) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL28827429 0.83 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL1844311 0.83 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL8313799 0.83 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL34433460 0.83 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL28509290 0.83 GABRA1 (0.55) GABRA1GABRG2GABRB3GABRB2LMNA
Benzene SCHEMBL7864298 0.83 GABRA1 (0.55) GABRA1GABRG2GABRB3GABRB2LMNA
Hydrochloric Acid SCHEMBL27766942 0.83 GABRA1 (0.55) GABRA1GABRG2GABRB3GABRB2LMNA

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118215695-A Method for producing aromatic polymeric carbodiimides 朗盛德国有限责任公司 2024-06-18 CN disclosed
WO-2023118036-A1 POLYMERIC CARBODIIMIDES, PROCESSES FOR THE PREPARATION AND USE THEREOF LANXESS DEUTSCHLAND GMBH (DE) 2023-06-29 WO disclosed
WO-2023083877-A1 METHOD FOR PRODUCING AROMATIC POLYMERIC CARBODIIMIDES LANXESS DEUTSCHLAND GMBH (DE) 2023-05-19 WO disclosed
EP-4180473-A1 METHOD FOR THE PREPARATION OF AROMATIC POLYMERS CARBODIIMIDES LANXESS Deutschland GmbH (DE) 2023-05-17 EP disclosed
CN-112543776-B Polymerizable composition and optical material prepared from same SKC株式会社 2023-04-04 CN disclosed
US-20210230458-A1 ADHESIVE SHEET NITTO DENKO CORPORATION (JP) 2021-07-29 US disclosed
US-20210222030-A1 PRESSURE-SENSITIVE ADHESIVE COMPOSITION, PRESSURE-SENSITIVE ADHESIVE LAYER, AND PRESSURE-SENSITIVE ADHESIVE SHEET NITTO DENKO CORPORATION (JP) 2021-07-22 US disclosed
EP-3805335-A1 PRESSURE-SENSITIVE ADHESIVE COMPOSITION, PRESSURE-SENSITIVE ADHESIVE LAYER, AND PRESSURE-SENSITIVE ADHESIVE SHEET NITTO DENKO CORPORATION (JP) 2021-04-14 EP disclosed
EP-3805332-A1 ADHESIVE SHEET NITTO DENKO CORPORATION (JP) 2021-04-14 EP disclosed
US-20200347277-A1 ADHESIVE COMPOSITION, ADHESIVE LAYER, AND ADHESIVE SHEET NITTO DENKO CORPORATION (JP) 2020-11-05 US disclosed
US-4108807-A REACTING A METALLATE WITH A PSEUDOHALIDE IN THE PRESENCE OF A PHENOL-SUBSTITUTED TERTIARY AMINE CATALYST CHEMIC-ANLAGENBAU BISCHOFSHEIM GMBH (DE) 1978-08-22 US disclosed
US-4098730-A Non-flammable organo-red mud polymers, some of which are electrically conductive, and process for their manufacture METALLGESELLSCHAFT AKTIENGESELLSCHAFT (DE) 1978-07-04 US disclosed
US-4086213-A FOR POLYURETHANE SYNTHESIS AIR PRODUCTS AND CHEMICALS, INC. (US) 1978-04-25 US disclosed
US-4051165-A Preparation of biuret polyisocyanates BAYER AKTIENGESELLSCHAFT (DT) 1977-09-27 US disclosed
US-RE29213-E TRIMELLITIC ANHYDRIDE, DIISOCYANATE, GLYCINE DERIVATIVE SCHENECTADY CHEMICALS, INC. (US) 1977-05-10 US disclosed
US-4001290-A LACQUERS, COATINGS, ADHESIVES, TELOMERS, FOAM PLASTICS BAYER AKTIENGESELLSCHAFT (DT) 1977-01-04 US disclosed
US-3988268-A Polyurethane foam plastics which contain ionic groups BAYER AKTIENGESELLSCHAFT (DT) 1976-10-26 US disclosed
US-3976622-A POLYURETHANES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-24 US disclosed
US-3969262-A Process for the production of synthetic plastics comprising urethane groups and biuret groups BAYER AKTIENGESELLSCHAFT (DT) 1976-07-13 US disclosed
US-3943159-A Process for the production of telomers containing isocyanate groups BAYER AKTIENGESELLSCHAFT (DT) 1976-03-09 US disclosed