SCHEMBL517130

SCHEMBL517130

Cc1ccccc1C(N)c1ccccc1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.54
ACHE P22303 2/20 0.47
TSHR P16473 2/20 0.47
CYP3A4 P08684 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ACP3 P15309 1/20 0.41
ALDH1A1 P00352 2/20 0.39
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
GAA P10253 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
TAAR1 Q96RJ0 1/20 0.36
SCN4A P35499 2/20 0.35
LMNA P02545 1/20 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
Sulfuric Acid SCHEMBL31314550 0.87 ESR1 (0.43) ESR1ACHETSHRCYP3A4TDP1
SCHEMBL3994648 0.85 ACP3 (0.48) ESR1CYP3A4ACP3SLC6A2SLC6A4
SCHEMBL20241459 0.85 ACP3 (0.48) ESR1CYP3A4ACP3SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL7646260 0.84 ACP3 (0.47) ESR1ACP3ALDH1A1SLC6A2SLC6A4
SCHEMBL24017139 0.83 ESR1 (0.54) ESR1ACHETSHRCYP3A4TDP1
SCHEMBL895700 0.83 ESR1 (0.54) ESR1ACHETSHRCYP3A4TDP1
SCHEMBL3255909 0.83 ESR1 (0.54) ESR1ACHETSHRCYP3A4TDP1
SCHEMBL3256967 0.83 ESR1 (0.54) ESR1ACHETSHRCYP3A4TDP1
SCHEMBL12569046 0.83 ESR1 (0.54) ESR1ACHETSHRCYP3A4TDP1
SCHEMBL18462075 0.82 ALDH1A1 (0.51) ESR1ACHETSHRCYP3A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5498549-A A FLUORESCENT POLYNUCLEAR COMPOUND COVALENTLY BONDED TO A POLYSILOXANE MATRIX, BLOOD GASES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-03-12 US claimed
US-11274179-B2 Method for producing compound having amide bond and also having alkoxysilyl group CANON KABUSHIKI KAISHA (JP) 2022-03-15 US disclosed
EP-2589701-B1 METHOD FOR PRODUCING SIZING AGENT-COATED CARBON FIBERS, AND SIZING AGENT-COATED CARBON FIBERS TORAY INDUSTRIES (JP) 2019-08-21 EP disclosed
US-10184034-B2 Carbon fiber forming raw material, formed material, and carbon fiber-reinforced composite material TORAY INDUSTRIES, INC. (JP) 2019-01-22 US disclosed
EP-2765155-B1 CARBON FIBER-REINFORCED THERMOPLASTIC RESIN MOLDING MATERIAL AND METHODS FOR PRODUCING SAME TORAY INDUSTRIES (JP) 2018-03-14 EP disclosed
US-9771681-B2 Method for producing sizing agent-coated carbon fibers, and sizing agent-coated carbon fibers TORAY INDUSTRIES, INC. (JP) 2017-09-26 US disclosed
US-9593444-B2 Method for producing sizing agent-coated carbon fibers, and sizing agent-coated carbon fibers TORAY INDUSTRIES, INC. (JP) 2017-03-14 US disclosed
US-20160272742-A1 IRON COMPLEXES AND METHODS FOR POLYMERIZATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-09-22 US disclosed
US-20160230332-A1 METHOD FOR PRODUCING SIZING AGENT-COATED CARBON FIBERS, AND SIZING AGENT-COATED CARBON FIBERS TORAY INDUSTRIES, INC. (JP) 2016-08-11 US disclosed
US-9290591-B2 Iron complexes and methods for polymerization PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2016-03-22 US disclosed
EP-0963567-A1 ASSEMBLY FOR RETAINING OPTICAL COMPONENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-12-15 EP disclosed
US-5997818-A FOR CALIBRATING SENSORS OF A BLOOD PARAMETER MEASUREMENT SYSTEM. MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-12-07 US disclosed
US-5822137-A Assembly for retaining optical components MINNESOTA MINING & MANUFACTURING CO. (US) 1998-10-13 US disclosed
WO-1998037800-A1 CASSETTE FOR TONOMETRIC CALIBRATION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-09-03 WO disclosed
WO-1998037801-A1 CASSETTE FOR MEASURING PARAMETERS OF BLOOD MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-09-03 WO disclosed
WO-1998038541-A1 ASSEMBLY FOR RETAINING OPTICAL COMPONENTS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-09-03 WO disclosed
US-5498549-A A FLUORESCENT POLYNUCLEAR COMPOUND COVALENTLY BONDED TO A POLYSILOXANE MATRIX, BLOOD GASES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-03-12 US disclosed
US-5409666-A Quantitative analysis MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-04-25 US disclosed
EP-0206621-B1 PROCESS FOR DISPROPORTIONATING SILANES MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-11-15 EP disclosed
EP-0206621-A1 Process for disproportionating silanes MITSUI TOATSU CHEMICALS, Inc. (JP) 1986-12-30 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 (1 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-20160272742-A1 IRON COMPLEXES AND METHODS FOR POLYMERIZATION FTH1, TFRC, FDPS ESR1 3190/4885ACHE 4733/4885TSHR 3620/4885

“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.