SCHEMBL9965812

SCHEMBL9965812

CN1CC(OCc2ccccc2)C1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.62
CTSB P07858 1/20 0.62
CTSK P43235 1/20 0.62
CARM1 Q86X55 2/20 0.53
PRMT6 Q96LA8 2/20 0.53
TMEM97 Q5BJF2 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
PRMT8 Q9NR22 1/20 0.53
HRH3 Q9Y5N1 1/20 0.53
NAAA Q02083 5/20 0.51
CHRM3 P20309 2/20 0.49
CHRM2 P08172 1/20 0.49
CHRM1 P11229 1/20 0.49
OPRM1 P35372 2/20 0.47
OPRL1 P41146 2/20 0.47
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45
DPP4 P27487 1/20 0.44
CHRM4 P08173 1/20 0.44

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
SCHEMBL14256118 0.93 CTSL (0.54) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL18596866 0.86 CARM1 (0.58) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL18596737 0.86 CARM1 (0.58) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL15800371 0.86 CARM1 (0.58) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL14256113 0.85 CTSL (0.48) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL16903412 0.84 CHRM2 (0.47) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL16903411 0.84 CHRM2 (0.47) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL14047773 0.83 CHRM2 (0.71) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL11226439 0.83 NAAA (0.45) CTSLCTSBCTSKCARM1PRMT6
SCHEMBL11222724 0.83 NAAA (0.60) CTSLCTSBCTSKTMEM97SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4360464-A Process for production of 1-aryloxy-aminopropane derivatives TEIKOKU HORMONE MFG. CO. LTD. (JP) 1982-11-23 US claimed
EP-3262036-B1 THERAPEUTIC PYRIDAZINE COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2023-09-13 EP disclosed
US-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2018-03-29 US disclosed
US-9718803-B2 Unsaturated nitrogen heterocyclic compounds useful as PDE10 inhibitors AMGEN INC. (US) 2017-08-01 US disclosed
US-20160102075-A1 UNSATURATED NITROGEN HETEROCYCLIC COMPOUNDS USEFUL AS PDE10 INHIBITORS AMGEN INC. (US) 2016-04-14 US disclosed
WO-2012151448-A1 PYRUVATE KINASE ACTIVATORS FOR USE IN THERAPY AGIOS PHARMACEUTICALS, INC. (US) 2012-11-08 WO disclosed
WO-2012083246-A1 NOVEL N- (4- (AZETIDINE - 1 - CARBONYL) PHENYL) - (HETERO - ) ARYLSULFONAMIDE DERIVATIVES AS PYRUVATE KINASE M2 (PMK2) MODULATORS AGIOS PHARMACEUTICALS, INC. (US) 2012-06-21 WO disclosed
US-4360464-A Process for production of 1-aryloxy-aminopropane derivatives TEIKOKU HORMONE MFG. CO. LTD. (JP) 1982-11-23 US disclosed
US-4018824-A ANTIULCER AND ADRENERGIC BLOCKING AGENTS TEIKOKU HORMONE MFG. CO., LTD. (JA) 1977-04-19 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 (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-20180086720-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF SMARCC1, SMARCC2, SMARCA4 CTSL 4628/4885CTSB 3378/4885CTSK 4259/4885
US-20160102075-A1 UNSATURATED NITROGEN HETEROCYCLIC COMPOUNDS USEFUL AS PDE10 INHIBITORS PDE10A, PDE2A, PDE3A CTSL 4716/4885CTSB 3940/4885CTSK 4340/4885

“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.