SCHEMBL425166

SCHEMBL425166

Cc1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
NPSR1 Q6W5P4 1/20 0.53
NR1H4 Q96RI1 1/20 0.52
PTGS2 P35354 1/20 0.52
LMNA P02545 1/20 0.50
CYP2A6 P11509 1/20 0.50
ACHE P22303 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
CYP2C19 P33261 1/20 0.48
HSD17B10 Q99714 1/20 0.48
AHR P35869 1/20 0.48

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
SCHEMBL21906402 1.00 CYP1A2 (0.55) CYP1A2CES2CES1NPSR1NR1H4
SCHEMBL23353552 0.92 AHR (0.54) CYP1A2CES2CES1NPSR1NR1H4
SCHEMBL28225760 0.90 CES2 (0.56) CYP1A2CES2CES1NPSR1NR1H4
SCHEMBL12679 0.90
SCHEMBL28318341 0.90 CES2 (0.62) CES2CES1NR1H4PTGS2LMNA
SCHEMBL6203955 0.90
Benzidine SCHEMBL28531320 0.87 ACHE (0.62) CYP1A2CES2CES1NPSR1NR1H4
Phosphine SCHEMBL22129260 0.87
Bromide SCHEMBL28687084 0.87 CES2 (0.59) CES2CES1NR1H4PTGS2LMNA
Hydrochloric Acid SCHEMBL8996220 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3166961-B1 N- (HYDROPHOBE-SUBSTITUTED) VANCOSAMINYL [PSI[C(=NH) NH] TPG4] VANCOMYCIN AND [PSI[CH2NH]TPG4] VANCOMYCIN SCRIPPS RESEARCH INST (US) 2023-06-07 EP claimed
US-20200071359-A1 PERIPHERAL MODIFICATIONS ON POCKET-REDESIGNED VANCOMYCIN ANALOGS SYNERGISTICALLY IMPROVE ANTIMICROBIAL POTENCY AND DURABILITY THE SCRIPPS RESEARCH INSTITUTE 2020-03-05 US claimed
US-10577395-B2 N-(hydrophobe-substituted) vancosaminyl [Ψ-[C(=NH) NH] Tpg4] vancomycin and [Ψ-[CH2NH]Tpg4] vancomycin THE SCRIPPS RESEARCH INSTITUTE (US) 2020-03-03 US claimed
EP-3532483-A1 PERIPHERAL MODIFICATIONS ON POCKET-REDESIGNED VANCOMYCIN ANALOGS SYNERGISTICALLY IMPROVE ANTIMICROBIAL POTENCY AND DURABILITY The Scripps Research Institute (US) 2019-09-04 EP claimed
WO-2018081797-A1 PERIPHERAL MODIFICATIONS ON POCKET-REDESIGNED VANCOMYCIN ANALOGS SYNERGISTICALLY IMPROVE ANTIMICROBIAL POTENCY AND DURABILITY THE SCRIPPS RESEARCH INSTITUTE (US) 2018-05-03 WO claimed
US-20170152291-A1 N- (HYDROPHOBE-SUBSTITUTED) VANCOSAMINYL [PSI-[C(=NH) NH] TPG4] VANCOMYCIN AND [PSI-[CH2NH]TPG4] VANCOMYCIN THE SCRIPPS RESEARCH INSTITUTE 2017-06-01 US claimed
EP-3166961-A1 N- (HYDROPHOBE-SUBSTITUTED) VANCOSAMINYL [PSI[C(=NH) NH] TPG4] VANCOMYCIN AND [PSI[CH2NH]TPG4] VANCOMYCIN The Scripps Research Institute (US) 2017-05-17 EP claimed
WO-2016007855-A1 N- (HYDROPHOBE-SUBSTITUTED) VANCOSAMINYL [Ψ[C(=NH) NH] TPG4] VANCOMYCIN AND [Ψ[CH2NH]TPG4] VANCOMYCIN THE SCRIPPS RESEARCH INSTITUTE (US) 2016-01-14 WO claimed
EP-0979809-B1 Process for the preparation of 4-chlorobiphenylenes CLARIANT GMBH (DE) 2003-01-29 EP claimed
US-6066766-A Process for the preparation of 4-chlorobiphenyls CLARIANT GMBH (DE) 2000-05-23 US claimed
EP-0979809-A1 Process for the preparation of 4-chlorobiphenylenes Clariant GmbH (DE) 2000-02-16 EP claimed
CN-117658785-A Preparation method of olanzapine side chain and preparation method of olanzapine 广东新达瑞生物科技有限公司 2024-03-08 CN disclosed
EP-4282861-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME Lapto Co., Ltd. (KR) 2023-11-29 EP disclosed
US-20230337527-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME LAPTO CO., LTD. (KR) 2023-10-19 US disclosed
US-20230301984-A1 CYCLIC COMPOUNDS FOR USE IN TREATING RETINAL DEGENERATION THE USA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-09-28 US disclosed
US-6156815-A Acid-curable binder systems containing 1,2-disulfones CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-12-05 US disclosed
US-6066766-A Process for the preparation of 4-chlorobiphenyls CLARIANT GMBH (DE) 2000-05-23 US disclosed
EP-0979809-A1 Process for the preparation of 4-chlorobiphenylenes Clariant GmbH (DE) 2000-02-16 EP disclosed
US-5985950-A Acid-curable binder systems containing 1,2 disulfones CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-11-16 US disclosed
US-5717003-A LATENT ACID CATALYST CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-02-10 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 (5 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-20230337527-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME AOC1, ODC1, PIEZO1 CYP1A2 670/4885CES2 176/4885CES1 441/4885
US-10577395-B2 N-(hydrophobe-substituted) vancosaminyl [Ψ-[C(=NH) NH] Tpg4] vancomycin and [Ψ-[CH2NH]Tpg4] vancomycin VNN1, VAC14, RPN1 CYP1A2 4812/4885CES2 3994/4885CES1 4062/4885
US-20230301984-A1 CYCLIC COMPOUNDS FOR USE IN TREATING RETINAL DEGENERATION ALDH1A2, PDE6D, PDE6C CYP1A2 3911/4885CES2 3547/4885CES1 2342/4885
US-20200071359-A1 PERIPHERAL MODIFICATIONS ON POCKET-REDESIGNED VANCOMYCIN ANALOGS SYNERGISTICALLY IMPROVE ANTIMICROBIAL POTENCY AND DURABILITY DDOST, DNPEP, AAAS CYP1A2 4721/4885CES2 1957/4885CES1 4297/4885
US-20170152291-A1 N- (HYDROPHOBE-SUBSTITUTED) VANCOSAMINYL [PSI-[C(=NH) NH] TPG4] VANCOMYCIN AND [PSI-[CH2NH]TPG4] VANCOMYCIN VPS4B, HPN, VNN1 CYP1A2 4694/4885CES2 1921/4885CES1 3265/4885

“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.