SCHEMBL175554

SCHEMBL175554

NC[C@@H](O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 6/20 0.62
▸ HTR3A P46098 1/20 0.62
▸ TSHR P16473 1/20 0.62
▸ NFKB1 P19838 1/20 0.62
▸ HIF1A Q16665 1/20 0.62
▸ KDM4E B2RXH2 2/20 0.60
▸ APEX1 P27695 2/20 0.60
▸ TDP1 Q9NUW8 2/20 0.60
▸ ALOX15 P16050 1/20 0.60
▸ HTR2A P28223 1/20 0.59
▸ LMNA P02545 2/20 0.58
▸ AOC3 Q16853 5/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ SLC6A2 P23975 1/20 0.56
▸ SLC6A4 P31645 1/20 0.56
▸ SLC6A3 Q01959 1/20 0.56
▸ PNMT P11086 1/20 0.52
▸ MEN1 O00255 1/20 0.50
▸ ADRB2 P07550 1/20 0.50
▸ ADRB1 P08588 1/20 0.50

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
SCHEMBL147501 1.00 TAAR1 (0.62) TAAR1HTR3ATSHRNFKB1HIF1A
SCHEMBL2021 1.00 TAAR1 (0.62) TAAR1HTR3ATSHRNFKB1HIF1A
Hydrochloric Acid SCHEMBL8178381 0.97 KDM4E (0.64) TAAR1HTR3ATSHRNFKB1HIF1A
Hydrochloric Acid SCHEMBL7153880 0.97 KDM4E (0.64) TAAR1HTR3ATSHRNFKB1HIF1A
Ammonia Solution, Strong SCHEMBL27544022 0.97 TAAR1 (0.60) TAAR1HTR3ATSHRNFKB1HIF1A
Hydrochloric Acid SCHEMBL29175850 0.97 KDM4E (0.64) TAAR1HTR3ATSHRNFKB1HIF1A
Bromide SCHEMBL29131747 0.97 TAAR1 (0.60) TAAR1HTR3ATSHRNFKB1HIF1A
SCHEMBL8339683 0.91 TAAR1 (0.56) TAAR1HTR3ATSHRNFKB1HIF1A
Monoethanolamine SCHEMBL9507297 0.91 TAAR1 (0.54) TAAR1HTR3ATSHRNFKB1HIF1A
Alcohol SCHEMBL1532267 0.91 LMNA (0.61) TAAR1HTR3ATSHRNFKB1HIF1A

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 1141 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250135005-A1 PROCESSES FOR PREPARING FUNCTIONALIZED CYCLOOCTENES TAMBO INC (US) 2025-05-01 — — US claimed
WO-2024169071-A1 METHOD FOR PREPARING SACUBITRIL COMPOUND BY MEANS OF ASYMMETRIC CATALYTIC HYDROGENATION 瑞博(苏州)制药有限公司 2024-08-22 — — WO claimed
CN-115974634-B Method for preparing Sha Kuba curved compound by asymmetric catalytic hydrogenation 瑞博(苏州)制药有限公司 2023-11-28 — — CN claimed
CN-111718362-B Preparation and application of chiral zinc complex 合肥工业大学 2023-06-20 — — CN claimed
CN-115974634-A Method for preparing Shakubatu compound by asymmetric catalytic hydrogenation 瑞博(苏州)制药有限公司 2023-04-18 — — CN claimed
US-20230048657-A1 PROCESS FOR THE PREPARATION OF (9S)-2-BROMO-9-(2,3,4-TRIFLUOROPHENYL)-6,7,8,9-TETRAHYDRO-5H-[1,2,4]TRIAZOLO[1,5-A]AZEPINE HOFFMANN-LA ROCHE INC. (US) 2023-02-16 — — US claimed
EP-4065581-A1 PROCESS FOR THE PREPARATION (9S)-2-BROMO-9-(2,3,4-TRIFLUOROPHENYL)-6,7,8,9-TETRAHYDRO-5H-[1,2,4]TRIAZOLO[1,5-A]AZEPINE F. Hoffmann-La Roche AG (CH) 2022-10-05 — — EP claimed
CN-114787163-A Process for preparing (9S) -2-bromo-9- (2,3, 4-trifluorophenyl) -6,7,8, 9-tetrahydro-5H- [1,2,4] triazolo [1,5-a ] azepine 豪夫迈·罗氏有限公司 2022-07-22 — — CN claimed
CN-112280761-B Recombinant transaminase, mutant of recombinant transaminase and application of mutant 清华大学 2022-04-12 — — CN claimed
US-20220033408-A1 PROCESS FOR PREPARING SPIRO DERIVATIVES JOHNSON MATTHEY PLC (GB) 2022-02-03 — — US claimed
EP-0654534-B1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEM (JP) 2000-03-01 — — EP claimed
WO-1999044985-A2 SYNTHESIS OF CHIRAL β-AMINO ACIDS G.D. SEARLE & CO. (US) 1999-09-10 — — WO claimed
EP-0939134-A1 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1999-09-01 — — EP claimed
US-5932742-A CHEMICAL INTERMEDIATE TO ACTIVE ANTITUMOR AGENT DONG WHA PHARM. IND. CO., LTD. (KR) 1999-08-03 — — US claimed
EP-0912495-A1 ASYMETRIC SYNTHESIS OF CHIRAL BETA-AMINO ACIDS G.D. SEARLE & CO. (US) 1999-05-06 — — EP claimed
US-5840961-A Asymmetric synthesis of chiral beta-amiNo acids G. D. SEARLE & CO. (US) 1998-11-24 — — US claimed
US-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 — — US claimed
WO-1998002410-A1 ASYMETRIC SYNTHESIS OF CHIRAL BETA-AMINO ACIDS G.D. SEARLE & CO. (US) 1998-01-22 — — WO claimed
EP-0654534-A2 Processes for producing optically active 2-amino-1-phenylethanol derivatives DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1995-05-24 — — EP claimed
EP-0005848-B1 N-ALKYLATED AMINOALCOHOLS AND THEIR SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1981-12-30 — — EP 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 (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-20230048657-A1 PROCESS FOR THE PREPARATION OF (9S)-2-BROMO-9-(2,3,4-TRIFLUOROPHENYL)-6,7,8,9-TETRAHYDRO-5H-[1,2,4]TRIAZOLO[1,5-A]AZEPINE APP, PSEN1, PSEN2 TAAR1 2149/4885HTR3A 12/4885TSHR 4050/4885
US-20220033408-A1 PROCESS FOR PREPARING SPIRO DERIVATIVES DHPS, TALDO1, FASTKD5 TAAR1 2043/4885HTR3A 2126/4885TSHR 2820/4885
US-20250135005-A1 PROCESSES FOR PREPARING FUNCTIONALIZED CYCLOOCTENES PPOX, SCO2, CYCS TAAR1 1065/4885HTR3A 2701/4885TSHR 3738/4885

“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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