SCHEMBL347187

SCHEMBL347187

CC(C)(C)Cc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.64
TAAR1 Q96RJ0 1/20 0.64
LMNA P02545 1/20 0.58
CYP2D6 P10635 1/20 0.58
ESR1 P03372 1/20 0.56
TRPA1 O75762 1/20 0.50
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP1A2 P05177 1/20 0.48
TP53 P04637 1/20 0.48
CALM1 P0DP23 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
HIF1A Q16665 1/20 0.44
RIPK1 Q13546 1/20 0.43
FDPS P14324 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CYP3A4 P08684 1/20 0.42
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
TSHR P16473 1/20 0.42

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
Ammonia Solution, Strong SCHEMBL10608295 0.97 SLC6A2 (0.61) SLC6A2TAAR1LMNACYP2D6ESR1
SCHEMBL6547275 0.90 CALM1 (0.57) SLC6A2TAAR1LMNACYP2D6ESR1
SCHEMBL13889581 0.85 ESR1 (0.54) SLC6A2TAAR1LMNACYP2D6ESR1
SCHEMBL6685103 0.84 ESR1 (0.74) SLC6A2TAAR1LMNACYP2D6ESR1
SCHEMBL8002017 0.83 SLC6A2 (0.58) SLC6A2TAAR1LMNACYP2D6ESR1
SCHEMBL7297621 0.82 ESR1 (0.47) SLC6A2TAAR1LMNACYP2D6ESR1
SCHEMBL1572105 0.82 SLC6A2 (0.64) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL4661772 0.80 SLC6A2 (0.61) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL28358439 0.80 SLC6A2 (0.61) SLC6A2TAAR1LMNACYP2D6TRPA1
SCHEMBL28276509 0.79 SLC6A2 (0.54) SLC6A2TAAR1LMNACYP2D6ESR1

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 1156 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12337304-B2 Palladium-containing composition and hydrogen peroxide production method MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2025-06-24 US claimed
CN-119954987-A Apoptosis bionic nano drug delivery carrier and preparation method and application thereof 暨南大学 2025-05-09 CN claimed
CN-119431101-A Preparation method of bis (4-tert-butylphenyl) iodonium trifluoromethane sulfonate 沾化大荣化工科技有限公司 2025-02-14 CN claimed
CN-118290322-A Aromatic molecules for the treatment of pathological conditions 赛尼欧普罗有限责任公司 2024-07-05 CN claimed
US-20240109866-A1 MELANOCORTIN SUBTYPE-2 RECEPTOR (MC2R) ANTAGONISTS AND USES THEREOF Crinetics Pharmaceuticals, Inc. 2024-04-04 US claimed
WO-2024024508-A1 COMPOSITION, FILM, OPTICAL FILTER, SOLID STATE IMAGING DEVICE, IMAGE DISPLAY DEVICE, INFRARED RADIATION SENSOR, AND METHOD FOR PRODUCING CAMERA MODULE 富士フイルム株式会社 2024-02-01 WO claimed
CN-114276260-B Preparation method of sun-screening agent UV A Plus 马鞍山科思化学有限公司 2023-11-10 CN claimed
CN-218047942-U Novel pipeline reactor for tert-butyl toluene 天津鼎晟新化科技有限公司 2022-12-16 CN claimed
US-20220354949-A1 NOVEL COMPOUNDS Xeniopro GmbH (DE) 2022-11-10 US claimed
CN-112142577-B Metal-free catalytic oxidation system, oxygen oxidation method and production method applied to benzoic acid derivative 浙江工业大学 2022-04-29 CN claimed
EP-0348464-B1 2-NEOPENTYLANTHRAQUINONE BASF Aktiengesellschaft (DE) 1993-03-31 EP claimed
US-5107004-A 2-NEOPENTYLANTHRAQUINONE, PROCESSES FOR ITS PREPARATION AND METHODS FOR ITS USE BASF AKTIENGESELLSCHAFT (DE) 1992-04-21 US claimed
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP claimed
EP-0244778-B1 MONO-TERTIARY-ALKYLATED TOLUENEDIISO-CYANATES AND DERIVATIVES AIR PRODUCTS AND CHEMICALS, INC. (US) 1991-10-16 EP claimed
EP-0348464-A1 2-NEOPENTYLANTHRAQUINONE BASF Aktiengesellschaft (DE) 1990-01-03 EP claimed
EP-0244778-A1 Mono-tertiary-alkylated toluenediiso-cyanates and derivatives AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-11-11 EP claimed
EP-0127410-B1 SELECTIVE CATALYTIC DEALKYLATION OF 1,4-DIALKYLBENZENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-08-26 EP claimed
US-4608391-A NERUOUS SYSTEM DISORDERS, PARKINSON$S DISEASE CORNELL RESEARCH FOUNDATION INC. (US) 1986-08-26 US claimed
US-4334115-A ISOBUTYLENE, ISOBUTANE, ACID CATALYSTS PHILLIPS PETROLEUM COMPANY (US) 1982-06-08 US claimed
US-4181811-A USING A CRYSTALLINE ALUMINA-SILICA ZEOLITE CATALYST TO PRODUCE 1,2 OR 1,3-ISOMERS MOBIL OIL CORPORATION (US) 1980-01-01 US claimed

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-20220354949-A1 NOVEL COMPOUNDS MUSK, TYR, IKZF3 SLC6A2 3872/4885TAAR1 3482/4885LMNA 3812/4885
US-20240109866-A1 MELANOCORTIN SUBTYPE-2 RECEPTOR (MC2R) ANTAGONISTS AND USES THEREOF MC3R, MC1R, MC2R SLC6A2 341/4885TAAR1 247/4885LMNA 4172/4885

“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.