SCHEMBL959063

SCHEMBL959063

CC(C)c1ccc(N=C=Nc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ GRIN2D O15399 3/20 0.41
▸ GRIN3B O60391 3/20 0.41
▸ GRIN1 Q05586 3/20 0.41
▸ GRIN2A Q12879 3/20 0.41
▸ GRIN2B Q13224 3/20 0.41
▸ GRIN2C Q14957 3/20 0.41
▸ GRIN3A Q8TCU5 3/20 0.41
▸ SIGMAR1 Q99720 1/20 0.41
▸ NOS3 P29474 3/20 0.40
▸ NOS1 P29475 3/20 0.40
▸ NOS2 P35228 2/20 0.40
▸ TYR P14679 2/20 0.39
▸ RAB9A P51151 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ IDO1 P14902 2/20 0.35

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
SCHEMBL7626805 0.83 CYP2C9 (0.44) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL1022395 0.81 MIF (0.50) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL26073571 0.81 CYP2C9 (0.42) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL14868084 0.81 CYP2C9 (0.42) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL131853 0.81 CYP3A4 (0.50) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL12024709 0.77 CYP2C9 (0.47) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
Propane SCHEMBL7071432 0.76 NOS3 (0.42) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL20251135 0.76 RAB9A (0.50) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL20251140 0.76 RAB9A (0.50) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B
SCHEMBL3188894 0.76 TYR (0.50) CYP2C9ALDH1A1SMN1; SMN2GRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10550351-B2 Refrigerator oil and refrigerator working fluid composition JX NIPPON OIL & ENERGY CORPORATION (JP) 2020-02-04 — — US claimed
US-20180134947-A1 METHODS FOR TREATING HIGH TEMPERATURE SUBTERRANEAN FORMATIONS SCHLUMBERGER TECHNOLOGY CORPORATION 2018-05-17 — — US claimed
WO-2016159817-A1 METHODS FOR TREATING HIGH TEMPERATURE SUBTERRANEAN FORMATIONS SCHLUMBERGER CANADA LIMITED (CA) 2016-10-06 — — WO claimed
US-12559624-B2 Film comprising polylactic acid polymer suitable for graphic articles 3M INNOVATIVE PROPERTIES COMPANY (US) 2026-02-24 — — US disclosed
US-20240294748-A1 FILM COMPRISING POLYLACTIC ACID POLYMER SUITABLE FOR GRAPHIC ARTICLES 3M INNOVATIVE PROPERTIES COMPANY (US) 2024-09-05 — — US disclosed
US-12080865-B2 Thermal regulation for electrical devices ARKEMA FRANCE (FR) 2024-09-03 — — US disclosed
US-12065531-B2 Polyglycolic acid resin and production process thereof PUJING CHEMICAL INDUSTRY CO., LTD. (CN) 2024-08-20 — — US disclosed
EP-4400530-A1 POLYESTER, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Zhuhai Wango Chemical Co., Ltd. (CN) 2024-07-17 — — EP disclosed
EP-4400529-A1 SEMI-AROMATIC POLYETHER ESTER, PREPARATION METHOD THEREFOR AND USE THEREOF Zhuhai Wango Chemical Co., Ltd. (CN) 2024-07-17 — — EP disclosed
EP-4400527-A1 SEMI-AROMATIC POLYESTER, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Zhuhai Wango Chemical Co., Ltd. (CN) 2024-07-17 — — EP disclosed
WO-2024106516-A1 WORKING FLUID COMPOSITION AND REFRIGERATOR ENEOS株式会社 2024-05-23 — — WO disclosed
EP-1640406-A1 ALIPHATIC POLYESTER RESIN COMPOSITION, METHOD FOR PRODUCTION THEREOF, MOLDED ARTICLE AND FOAMED ARTICLE COMPRISING THE RESIN COMPOSITION UNITIKA LTD. (JP) 2006-03-29 — — EP disclosed
US-20040242803-A1 Resin composition and molded article, film, and fiber each comprising the same TORAY INDUSTRIES, INC. (JP) 2004-12-02 — — US disclosed
EP-1445282-A1 RESIN COMPOSITION AND MOLDED ARTICLE FILM AND FIBER EACH COMPRISING THE SAME TORAY INDUSTRIES, INC. (JP) 2004-08-11 — — EP disclosed
EP-0647701-B1 REFRIGERATOR LUBRICANT AND REFRIGERANT COMPOSITION CONTAINING THE SAME ASAHI DENKA KOGYO KK (JP) 1999-10-06 — — EP disclosed
US-5498356-A LUBRICANTS AND COOLANTS ASAHI DENKA KOGYO K.K. (JP) 1996-03-12 — — US disclosed
EP-0647701-A1 REFRIGERATOR LUBRICANT AND REFRIGERANT COMPOSITION CONTAINING THE SAME ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1995-04-12 — — EP disclosed
EP-0200030-B1 PROCESS FOR THE PREPARATION OF (METH)ACRYLIC-ACID ESTERS, AND THEIR USE BAYER AG (DE) 1988-06-15 — — EP disclosed
US-4748269-A LOW SAPONIFICATION NUMBER BAYER AKTIENGESELLSCHAFT (DE) 1988-05-31 — — US disclosed
EP-0200030-A2 Process for the preparation of (meth)acrylic-acid esters, and their use BAYER AG (DE) 1986-11-05 — — EP 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 (2 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-12065531-B2 Polyglycolic acid resin and production process thereof RPN2, RIOX2, RPN1 CYP2C9 2960/4885ALDH1A1 3675/4885SMN1; SMN2 3928/4885
US-12559624-B2 Film comprising polylactic acid polymer suitable for graphic articles POT1, PARG, TCP1 CYP2C9 4017/4885ALDH1A1 373/4885SMN1; SMN2 343/4885

“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.

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