SCHEMBL4436919

SCHEMBL4436919

CC1C[CH]c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
HTR2A P28223 2/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
NOTUM Q6P988 1/20 0.32
BRD4 O60885 1/20 0.32
CCL2 P13500 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
CHRNA7 P36544 1/20 0.30

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
SCHEMBL2875769 0.77 BRD4 (0.38) CYP19A1CYP11B1CYP11B2HTR2ANOS3
SCHEMBL25378607 0.77 CYP19A1 (0.36) CYP19A1CYP11B1CYP11B2HTR2ANOS3
SCHEMBL30485647 0.77 BRD4 (0.38) CYP19A1CYP11B1CYP11B2HTR2ANOS3
SCHEMBL1450862 0.71 MAOA (0.33) HTR2A
SCHEMBL7467393 0.71 HTR2A (0.38) HTR2AALDH1A1MAPT
SCHEMBL7472007 0.71 HTR2C (0.31) HTR2C
SCHEMBL4430948 0.68 MEN1 (0.40)
SCHEMBL2443334 0.67 ALDH1A1 (0.35) HTR2AHTR2CHTR2BALDH1A1MAPT
SCHEMBL2445328 0.67 ALDH1A1 (0.35) HTR2AHTR2CHTR2BALDH1A1MAPT
SCHEMBL21505247 0.67 CYP19A1 (0.38) CYP19A1CYP11B1CYP11B2HTR2ANOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9182669-B2 Copolymer with acid-labile group, photoresist composition, coated substrate, and method of forming an electronic device ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2015-11-10 US disclosed
US-20150177614-A1 COPOLYMER WITH ACID-LABILE GROUP, PHOTORESIST COMPOSITION, COATED SUBSTRATE, AND METHOD OF FORMING AN ELECTRONIC DEVICE U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2015-06-25 US disclosed
US-20090082394-A1 Tetrahydroisoquinoline Derivatives to Enhance Memory Function ACTELION PHARMACEUTICALS, LTD. (CH) 2009-03-26 US disclosed
EP-1998774-A1 TETRAHYDROISOQUINOLINE DERIVATIVES TO ENHANCE MEMORY FUNCTION Actelion Pharmaceuticals Ltd. (CH) 2008-12-10 EP disclosed
WO-2007105177-A1 TETRAHYDROISOQUINOLINE DERIVATIVES TO ENHANCE MEMORY FUNCTION ACTELION PHARMACEUTICALS LTD (CH) 2007-09-20 WO 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-20090082394-A1 Tetrahydroisoquinoline Derivatives to Enhance Memory Function GRIN2A, BDNF, GRIN2C CYP19A1 2476/4885CYP11B1 1200/4885CYP11B2 937/4885

“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.