SCHEMBL387514

SCHEMBL387514

Cc1cccc(CCN)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 10/20 1.00
DRD2 P14416 1/20 0.57
DRD1 P21728 1/20 0.57
IDO1 P14902 2/20 0.55
HTR7 P34969 1/20 0.55
CYP2A6 P11509 2/20 0.54
CYP1A2 P05177 1/20 0.54
HTR2A P28223 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
LOXL2 Q9Y4K0 1/20 0.52
HTR6 P50406 2/20 0.52
HRH3 Q9Y5N1 1/20 0.52
NOS1 P29475 1/20 0.52
HTR2C P28335 1/20 0.50
ACHE P22303 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
Hydrochloric Acid SCHEMBL1028506 0.98 TAAR1 (0.96) TAAR1DRD2DRD1IDO1HTR7
SCHEMBL2673980 0.87 TAAR1 (0.77) TAAR1IDO1CYP2A6HTR6HRH3
SCHEMBL8096473 0.85 TAAR1 (0.74) TAAR1IDO1HRH3NOS1ACHE
SCHEMBL29596752 0.85 TAAR1 (0.74) TAAR1IDO1HRH3NOS1ACHE
Hydrochloric Acid SCHEMBL1028929 0.85 TAAR1 (0.74) TAAR1IDO1CYP2A6HTR6HRH3
SCHEMBL8605570 0.85 TAAR1 (0.74) TAAR1IDO1HRH3
SCHEMBL9848072 0.84 TAAR1 (0.71) TAAR1IDO1HRH3
SCHEMBL8502036 0.84 TAAR1 (0.71) TAAR1IDO1HRH3
SCHEMBL659100 0.83 TAAR1 (0.70) TAAR1DRD2DRD1HTR7CYP2A6
SCHEMBL8092500 0.81 TAAR1 (0.68) TAAR1IDO1HRH3HTR2CACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4683622-A1 NON-DISTILLATIVE PROCESS FOR MANUFACTURING HIGH PURITY AMPHETAMINES Pharmapotheca A, Inc. (US) 2026-01-28 EP claimed
WO-2025029594-A2 BROAD-WAVELENGTH OPTICAL RETARDATION THROUGH IN-PLANE OPTICAL ANISOTROPY OF SINGLE CRYSTALLINE MATERIALS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2025-02-06 WO claimed
CN-119192880-A Preparation method of archaized pigment 江苏众立生包装科技有限公司 2024-12-27 CN claimed
WO-2024175957-A1 NON-DISTILLATIVE PROCESS FOR MANUFACTURING HIGH PURITY AMPHETAMINES Pharmapotheca A, Inc. (US) 2024-08-29 WO claimed
US-20240199542-A1 SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-06-20 US claimed
CN-117946370-A Ester bond curing agent, degradable epoxy resin and preparation of composite material thereof 四川大学 2024-04-30 CN claimed
EP-4313943-A1 SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2024-02-07 EP claimed
WO-2022200208-A1 SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2022-09-29 WO claimed
CN-109563085-B Piperidine CXCR7 receptor modulators 爱杜西亚药品有限公司 2022-08-09 CN claimed
EP-3490986-B1 PIPERIDINE CXCR7 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-11-24 EP claimed
EP-2228065-B1 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB CO (US) 2012-12-26 EP claimed
EP-2205573-A1 TETRAZOLE-SUBSTITUTED ARYL AMIDE DERIVATIVES AND USES THEREOF F. Hoffmann-Roche AG (CH) 2010-07-14 EP claimed
US-20090131336-A1 Isoxazole Derivatives and Use Thereof SK BIOPHARMACEUTICALS CO., LTD. (KR) 2009-05-21 US claimed
WO-2009043780-A1 TETRAZOLE-SUBSTITUTED ARYL AMIDE DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2009-04-09 WO claimed
EP-1971600-A1 ISOXAZOLE DERIVATIVES AND USE THEREOF SK Holdings Co., Ltd. (KR) 2008-09-24 EP claimed
EP-1450796-B1 BENZOTHIAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2008-04-09 EP claimed
WO-2007078113-A1 ISOXAZOLE DERIVATIVES AND USE THEREOF SK HOLDINGS CO., LTD. (KR) 2007-07-12 WO claimed
EP-1450796-A1 BENZOTHIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-09-01 EP claimed
US-6596718-B1 A compound of formula I has a good affinity to the A2A receptor and is useful for the treatment of diseases mediated by this receptor. HOFFMANN-LA ROCHE INC. 2003-07-22 US claimed
WO-2003045385-A1 BENZOTHIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-06-05 WO 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-20240199542-A1 SUBSTITUTED PYRROLIDIN-2-ONES, SALTS THEREOF AND THEIR USE AS HERBICIDALLY ACTIVE SUBSTANCES HPD, DDT, PPOX TAAR1 3744/4885DRD2 362/4885DRD1 277/4885
US-20090131336-A1 Isoxazole Derivatives and Use Thereof WNT3A, WNT1, WNT3 TAAR1 4762/4885DRD2 3882/4885DRD1 3466/4885

“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.