SCHEMBL1848300

SCHEMBL1848300

CC(C)Cc1ccc(S)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 4/20 0.47
▸ PTGS2 P35354 4/20 0.47
▸ LMNA P02545 2/20 0.47
▸ CYP2C9 P11712 2/20 0.47
▸ AKR1C3 P42330 2/20 0.47
▸ CXCR1 P25024 2/20 0.47
▸ CXCR2 P25025 2/20 0.47
▸ ALOX5 P09917 2/20 0.47
▸ ALB P02768 1/20 0.47
▸ ESR1 P03372 1/20 0.47
▸ RARB P10826 1/20 0.47
▸ ADRB3 P13945 1/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ HTR2A P28223 1/20 0.47
▸ NR1I3 Q14994 1/20 0.47
▸ SLC22A6 Q4U2R8 1/20 0.47
▸ CXCL8 P10145 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ AKR1C2 P52895 1/20 0.47
▸ BLM P54132 1/20 0.47

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
SCHEMBL1131597 0.86 PTGS1 (0.56) PTGS1PTGS2LMNACYP2C9AKR1C3
SCHEMBL5174938 0.83 PTGS1 (0.54) PTGS1PTGS2LMNACYP2C9AKR1C3
Hydrogen Peroxide SCHEMBL9581174 0.80 PTGS1 (0.64) PTGS1PTGS2LMNACYP2C9AKR1C3
SCHEMBL28688350 0.80 TAAR1 (0.61) —
SCHEMBL9642870 0.79 IDO1 (0.52) PTGS1PTGS2LMNACYP2C9AKR1C3
SCHEMBL9146880 0.78 ESR1 (0.35) ESR1
SCHEMBL9146878 0.78 ESR1 (0.35) ESR1
SCHEMBL8120565 0.78 PTGS1 (0.50) PTGS1PTGS2LMNACYP2C9AKR1C3
SCHEMBL9176049 0.78 PTGS1 (0.50) PTGS1PTGS2LMNACYP2C9AKR1C3
SCHEMBL8636154 0.78 MEN1 (0.53) PTGS1PTGS2LMNACYP2C9AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114423742-B Benzotriazole-based compound, light absorber and resin composition 三井化学株式会社 2024-05-28 — — CN claimed
CN-114423742-B Benzotriazole-based compound, light absorber and resin composition 三井化学株式会社 2024-05-28 — — CN disclosed
CN-117466830-A Benzotriazole-based compound, light absorber and resin composition 三井化学株式会社 2024-01-30 — — CN disclosed
WO-2024005030-A1 DIPHENYLETHENE-BASED COMPOUND, LIGHT ABSORBER, RESIN COMPOSITION, AND USE THEREOF 山本化成株式会社 2024-01-04 — — WO disclosed
EP-4236660-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2023-08-30 — — EP disclosed
US-20220285620-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2022-09-08 — — US disclosed
CN-114423742-A Benzotriazole compound, light absorber, and resin composition 三井化学株式会社 2022-04-29 — — CN disclosed
EP-3611175-B1 NAPHTHALOCYANINE COMPOUND, METHOD FOR PRODUCING SAME, AND USE THEREOF YAMAMOTO CHEMICALS INC (JP) 2022-02-09 — — EP disclosed
WO-2022008475-A1 INDOLE DERIVATIVES AND USES THEREOF FOR TREATING A CANCER UNIVERSITE CLAUDE BERNARD LYON 1 (FR) 2022-01-13 — — WO disclosed
US-11174274-B2 Naphthalocyanine compound, method for producing same, and use thereof YAMAMOTO CHEMICALS, INC. (JP) 2021-11-16 — — US disclosed
EP-2323974-A1 METHODS FOR PREPARING FLUOROALKYL ARYLSULFINYL COMPOUNDS AND FLUORINATED COMPOUNDS THERETO Ube Industries, Ltd. (JP) 2011-05-25 — — EP disclosed
US-20100152463-A1 Methods for Preparing Fluoroalkyl Arylsulfinyl Compounds and Fluorinated Compounds Thereto IM&T RESEARCH, INC. (US) 2010-06-17 — — US disclosed
WO-2010022001-A1 METHODS FOR PREPARING FLUOROALKYL ARYLSULFINYL COMPOUNDS AND FLUORINATED COMPOUNDS THERETO IM&T RESEARCH, INC. (US) 2010-02-25 — — WO disclosed
WO-2009114409-A2 FLUORINATION PROCESSES WITH ARYLSULFUR HALOTETRAFLUORIDES IM & T RESEARCH, INC. (US) 2009-09-17 — — WO disclosed
US-20070218216-A1 Light modulating material FUJIFILM CORPORATION 2007-09-20 — — US disclosed
EP-0517214-B1 Silver halide color photographic light-sensitive material, and method of processing the same FUJI PHOTO FILM CO LTD (JP) 1998-01-07 — — EP disclosed
US-5306603-A Containing specified compound releasing photographically useful group and yellow-colored cyan coupler FUJI PHOTO FILM CO., LTD. (JP) 1994-04-26 — — US disclosed
EP-0517214-A1 Silver halide color photographic light-sensitive material, and method of processing the same FUJI PHOTO FILM CO., LTD. (JP) 1992-12-09 — — EP disclosed
US-4334078-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIRHEUMATICS HOFFMANN-LA ROCHE INC. (US) 1982-06-08 — — US disclosed
US-4219657-A USED AS ANTIINFLAMATORY AGENTS, ANALGESICS, ANTIRHEUMATIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1980-08-26 — — 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 (3 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-20100152463-A1 Methods for Preparing Fluoroalkyl Arylsulfinyl Compounds and Fluorinated Compounds Thereto PFAS, AGPS, FDPS PTGS1 3460/4885PTGS2 3708/4885LMNA 2438/4885
US-20220285620-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME ASH2L, EHMT2, H1-2 PTGS1 3329/4885PTGS2 2925/4885LMNA 1439/4885
US-11174274-B2 Naphthalocyanine compound, method for producing same, and use thereof MRPS9, INTS9, RPL19 PTGS1 2837/4885PTGS2 2664/4885LMNA 2412/4885

“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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