SCHEMBL6909918

SCHEMBL6909918

CC(C)c1cccc2c1C=CC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.41
GABRG2 P18507 2/20 0.41
GABRB3 P28472 2/20 0.41
GABRB2 P47870 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
FAAH O00519 2/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.41
GABRB1 P18505 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2C P28335 1/20 0.41
GABRA5 P31644 1/20 0.41
GABRA3 P34903 1/20 0.41
HTR2B P41595 1/20 0.41
GABRA2 P47869 1/20 0.41

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
SCHEMBL7186336 0.88 CA1 (0.32) GABRA1GABRG2GABRB3GABRB2CA1
SCHEMBL5698312 0.84 P2RX7 (0.36) GABRA1GABRG2GABRB3GABRB2CA1
SCHEMBL29734610 0.84 CYP1A2 (0.41) GABRA1GABRG2GABRB3GABRB2CA1
SCHEMBL5344889 0.83 CA1 (0.35) GABRA1GABRG2GABRB3GABRB2CA1
SCHEMBL8166449 0.79 GPR84 (0.33)
SCHEMBL6655311 0.76 CA1 (0.33) GABRA1GABRG2GABRB3GABRB2CA1
SCHEMBL6745345 0.76 CA1 (0.36) GABRA1GABRG2GABRB3CA1CA2
SCHEMBL319418 0.74 CYP2A6 (0.35) CA1CA2CYP1A2HPGDTSHR
SCHEMBL8766117 0.74 CA1 (0.32) CA1CA2
SCHEMBL16332918 0.73 BRD4 (0.36) CA1CA2LMNAHPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112105654-A Curable resin mixture, curable resin composition, and cured product thereof 日本化药株式会社 2020-12-18 CN disclosed
WO-2020031935-A1 CURABLE RESIN MIXTURE, CURABLE RESIN COMPOSITION, AND CURED PRODUCT 日本化薬株式会社 2020-02-13 WO disclosed
CN-1189435-C Novel transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2005-02-16 CN disclosed
EP-0969010-B1 Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2004-09-22 EP disclosed
EP-0773204-B1 Process for the preparation of an indene and use thereof for the preparation of metallocenes BASELL POLYOLEFINE GMBH (DE) 2002-12-04 EP disclosed
US-6352953-B1 TRANSITION METAL COMPLEX HAVING 5-MEMBERED RING FORMED BY TRANSITION METAL COMPOUND OF GROUP IVB, TWO CARBONS, METAL OF GROUP IIIA AND HYDROGEN JAPAN POLYOLEFINS CO., LTD. (JP) 2002-03-05 US disclosed
US-6150544-A Transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO., LTD. (JP) 2000-11-21 US disclosed
EP-0994911-A1 PROCESS FOR PRODUCING AN ADHERENT POLYMERIC LAYER ON POLYMERIC SUBSTRATES AND ARTICLES PRODUCED THEREBY PPG Industries Ohio, Inc. (US) 2000-04-26 EP disclosed
CN-1240782-A Novel transition metal compound and catalyst containing the same for polymerization of olefins JAPAN POLYOLEFINS CO LTD (JP) 2000-01-12 CN disclosed
EP-0969010-A2 Transition metal compound and catalyst containing the same for polymerization of olefins Japan Polyolefins Co., Ltd. (JP) 2000-01-05 EP disclosed
WO-1999000448-A1 PROCESS FOR PRODUCING AN ADHERENT POLYMERIC LAYER ON POLYMERIC SUBSTRATES AND ARTICLES PRODUCED THEREBY TRANSITIONS OPTICAL, INC. (US) 1999-01-07 WO disclosed
EP-0530647-B1 Metallocenes, catalysts containing these and process for the manufacture of olefinic polymers by using these catalysts HOECHST AG (DE) 1998-01-28 EP disclosed
EP-0773204-A2 Process for the preparation of an indene and use thereof for the preparation of metallocenes HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-14 EP disclosed
US-5329033-A Metallocene catalyst, indene containing ligands, alumoxane cocatalyst HOECHST AKTIENGESELLSCHAFT (DE) 1994-07-12 US disclosed
US-5278264-A Catalytic polymerizing in presence of a transition metal metallocene HOECHST AG (DE) 1994-01-11 US disclosed
EP-0530647-A1 Metallocenes, catalysts containing these and process for the manufacture of olefinic polymers by using these catalysts HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-10 EP disclosed