SCHEMBL7963983

SCHEMBL7963983

Nc1ccccc1C1CNCCO1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.46
DRD3 P35462 1/20 0.46
HTR2A P28223 1/20 0.44
PRKACA P17612 1/20 0.44
PRKACG P22612 1/20 0.44
PRKACB P22694 1/20 0.44
HTR1A P08908 1/20 0.43
HRH1 P35367 2/20 0.38
KCNH2 Q12809 2/20 0.38
CYP2D6 P10635 1/20 0.38

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
SCHEMBL28800766 0.84 DRD2 (0.46) DRD2DRD3PRKACAPRKACGPRKACB
SCHEMBL1372580 0.81 DRD2 (0.46) DRD2DRD3HTR2APRKACAPRKACG
SCHEMBL11632146 0.81 PRKACA (0.52) DRD2DRD3PRKACAPRKACGPRKACB
SCHEMBL28806973 0.81 PRKACA (0.55) DRD2DRD3HTR2APRKACAPRKACG
SCHEMBL27948443 0.81 PRKACA (0.55) DRD2DRD3HTR2APRKACAPRKACG
SCHEMBL1639063 0.79 DRD2 (0.46) DRD2DRD3HTR2AHTR1A
SCHEMBL30752424 0.79 DRD2 (0.46) DRD2DRD3HTR2AHTR1A
SCHEMBL2787499 0.79 HTR1A (0.47) DRD2DRD3HTR2AHTR1AHRH1
SCHEMBL1176963 0.79 DRD2 (0.46) DRD2DRD3HTR2AHTR1AHRH1
SCHEMBL10746746 0.79 HTR2C (0.47) DRD2DRD3HTR2AHTR1AHRH1

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240336593-A1 Compound Having Antitumor Activity And Use Thereof INNOVSTONE THERAPEUTICS LIMITED (CN) 2024-10-10 US disclosed
EP-4209485-A1 COMPOUND HAVING ANTITUMOR ACTIVITY AND USE THEREOF Innovstone Therapeutics Limited (CN) 2023-07-12 EP disclosed
WO-2022048631-A1 COMPOUND HAVING ANTITUMOR ACTIVITY AND USE THEREOF 上海翊石医药科技有限公司 2022-03-10 WO disclosed
CN-109666027-A GPR40 agonist compound of a kind of amide structure and application thereof 中国科学院上海药物研究所 2019-04-23 CN disclosed
CN-107793363-A A kind of substituted aromatic amines base heteroaromatic class compound and its application as antineoplastic 上海医药工业研究院 2018-03-13 CN disclosed
CN-103896937-A 1,2-benzisothiazol-3-one-1,2,3-triazole derivatives and application thereof UNIV TIANJIN SCIENCE & TECH 2014-07-02 CN disclosed
US-6316482-B1 FOR THERAPY AND PROPHYLAXIS OF HYPERTENSION, HEART FAILURE, RENAL INSUFFICIENCY, EDEMA, ASCITES, VASOPRESSIN PARASECRETION SYNDROME, HEPATOCIRRHOSIS, HYPONATREMIA, HYPOKALEMIA, DIABETIC, CIRCULATION DISORDER, CEREBROVASCULAR DISEASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-11-13 US disclosed
US-6207693-B1 Benzamide derivatives having a vasopressin antagonistic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-27 US disclosed
EP-0750662-A1 BREAKAGE-RESISTANT POLYFUNCTIONAL CLEANING TABLETS WITH A LONG SHELF LIFE, PROCESS FOR PRODUCING THEM AND THEIR USE Henkel Kommanditgesellschaft auf Aktien (DE) 1997-01-02 EP disclosed
WO-1995025161-A1 BREAKAGE-RESISTANT POLYFUNCTIONAL CLEANING TABLETS WITH A LONG SHELF LIFE, PROCESS FOR PRODUCING THEM AND THEIR USE HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1995-09-21 WO disclosed
EP-0073835-B1 PROCESS FOR PRODUCING POLYURETHANE POLYMER Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1986-04-09 EP disclosed
US-4168151-A HERBICIDES UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-09-18 US disclosed
US-4153443-A HERBICIDES UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-05-08 US disclosed
US-4153443-A HERBICIDES UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-05-08 US disclosed
US-4133673-A HERBICIDES UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-01-09 US disclosed
US-4133673-A HERBICIDES UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-01-09 US disclosed
US-4133672-A (Aminophenyl)morpholines and use thereof UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-01-09 US disclosed
US-4133672-A (Aminophenyl)morpholines and use thereof UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1979-01-09 US disclosed
US-4126442-A O-Phosphoroamidophenylmorpholine compounds and use as herbicides UNITED STATES BORAX & CHEMICAL CORP. (US) 1978-11-21 US disclosed
US-4123251-A HERBICIDES UNITED STATES BORAX & CHEMICAL CORPORATION (US) 1978-10-31 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 (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-20240336593-A1 Compound Having Antitumor Activity And Use Thereof PRMT5, PRMT1, PRMT6 DRD2 4482/4885DRD3 4550/4885HTR2A 4761/4885

“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.