SCHEMBL72569

SCHEMBL72569

N#Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.68
MMP3 P08254 1/20 0.61
CYP11B2 P19099 1/20 0.59
GABRA1 P14867 1/20 0.58
GABRG2 P18507 1/20 0.58
GABRB3 P28472 1/20 0.58
GABRA5 P31644 1/20 0.58
GABRA3 P34903 1/20 0.58
MAOB P27338 3/20 0.56
MAOA P21397 2/20 0.56
KIF11 P52732 2/20 0.54
ALDH1A3 P47895 1/20 0.53
CYP1A1 P04798 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP1B1 Q16678 1/20 0.52
CA12 O43570 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
ALDH1A1 P00352 2/20 0.50
CA1 P00915 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
Benzene SCHEMBL28680466 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
Water SCHEMBL27280762 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
SCHEMBL1978798 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
Water SCHEMBL27280164 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
Water SCHEMBL6336152 1.00 TSHR (0.68) TSHRMMP3CYP11B2GABRA1GABRG2
Hydrochloric Acid SCHEMBL4599950 0.97 TSHR (0.65) TSHRMMP3CYP11B2GABRA1GABRG2
SCHEMBL28503971 0.97 TSHR (0.65) TSHRMMP3CYP11B2GABRA1GABRG2
Hydrochloric Acid SCHEMBL2338378 0.97 TSHR (0.65) TSHRMMP3CYP11B2GABRA1GABRG2
Cyanide SCHEMBL28220142 0.95 TSHR (0.62) TSHRMMP3CYP11B2GABRA1GABRG2
SCHEMBL13682562 0.93 TSHR (0.59) TSHRMMP3CYP11B2GABRA1GABRG2

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 1539 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12570632-B2 Indole derivatives and uses thereof for treating a cancer UNIVERSITE CLAUDE BERNARD LYON 1 (FR) 2026-03-10 US claimed
US-12534685-B2 Fragrance composition SYMRISE AG (DE) 2026-01-27 US claimed
CN-120060672-A Method for selectively separating and extracting gallium 安徽工业大学 2025-05-30 CN claimed
CN-120028308-A Small molecule Raman probe, bar code probe, encoding method and application thereof 北京大学 2025-05-23 CN claimed
WO-2025059252-A1 POLYMER INTERLAYERS PROVIDED WITH ELECTROCHROMIC MATERIALS SOLUTIA INC. (US) 2025-03-20 WO claimed
WO-2025059249-A1 POLYMER INTERLAYERS PROVIDED WITH ELECTROCHROMIC MATERIALS SOLUTIA INC. (US) 2025-03-20 WO claimed
WO-2025059262-A1 POLYMER INTERLAYERS PROVIDED WITH ELECTROCHROMIC MATERIALS SOLUTIA INC. (US) 2025-03-20 WO claimed
WO-2025059295-A1 POLYMER INTERLAYERS PROVIDED WITH ELECTROCHROMIC MATERIALS SOLUTIA INC. (US) 2025-03-20 WO claimed
CN-119524933-A Quaternized covalent triazine regular pore anion exchange membrane and preparation method thereof 黑龙江大学 2025-02-28 CN claimed
CN-115427409-B Pyrimidine-4 (3H) -one derivatives as TRPV4 antagonists 拉夸里亚创药株式会社 2025-02-25 CN claimed
WO-1996016027-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-05-30 WO claimed
EP-0463931-B1 Amorphous copolymers, translucent to visible light, for applications in non linear optics THOMSON CSF (FR) 1996-04-24 EP claimed
US-4722804-A Liquid crystal composition SHARP KABUSHIKI KAISHA (JP) 1988-02-02 US claimed
US-4720305-A Mixtures of pigments CIBA-GEIGY CORPORATION (US) 1988-01-19 US claimed
US-4395350-A Liquid crystal mixtures HOFFMANN-LA ROCHE INC. (US) 1983-07-26 US claimed
EP-0043904-A2 Mixtures containing a dyestuff, dyestuffs and their use in liquid crystal mixtures F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1982-01-20 EP claimed
US-4232949-A ANTHRAQUINONE DYES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1980-11-11 US claimed
US-4232950-A ANTHRAQUINONE DYES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1980-11-11 US claimed
US-4208106-A FLUORESCENT DYE, LIQUID CRYSTAL BECKMAN INSTRUMENTS, INC. (US) 1980-06-17 US claimed
US-4019996-A CONTAINING MONOCYANO-PHENOXYBENZENE, -DIPHENYL OR -TERPHENYL IN A LIQUID RHONE-POULENC INDUSTRIES (FR) 1977-04-26 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-12534685-B2 Fragrance composition NCLN, HCN2, TRPA1 TSHR 3358/4885MMP3 3896/4885CYP11B2 1647/4885
US-12570632-B2 Indole derivatives and uses thereof for treating a cancer CKS2, CSNK2A3, CSNK1A1L TSHR 503/4885MMP3 3400/4885CYP11B2 258/4885

“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.