SCHEMBL9000104

SCHEMBL9000104

CCN(CC)P(c1cccc2c1Oc1c(P(N(CC)CC)N(CC)CC)cccc1C2(C)C)N(CC)CC

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 2/20 0.54
HTR2A P28223 1/20 0.31

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
SCHEMBL31738206 1.00 DRD1 (0.54) DRD1HTR2A
SCHEMBL709870 0.78 DRD1 (0.58) DRD1HTR2A
SCHEMBL29867917 0.78 DRD1 (0.58) DRD1HTR2A
SCHEMBL709261 0.75 DRD1 (0.64) DRD1
SCHEMBL29867522 0.75 DRD1 (0.64) DRD1
SCHEMBL12337520 0.75 DRD1 (0.62) DRD1
SCHEMBL21374252 0.74 DRD1 (0.62) DRD1
SCHEMBL30066813 0.74 DRD1 (0.62) DRD1
SCHEMBL15871415 0.74 DRD1 (0.62) DRD1
SCHEMBL20661508 0.73 DRD1 (0.53) DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10173993-B2 Process for the synthesis of sulfones and sulfonamides COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2019-01-08 US disclosed
US-20170166542-A1 Process for the Synthesis of Sulfones and Sulfonamides COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2017-06-15 US disclosed
EP-3178811-A1 A PROCESS FOR THE SYNTHESIS OF SULFONES AND SULFONAMIDES COMMISSARIAT À L'ÉNERGIE ATOMIQUE ET AUX ÉNERGIES ALTERNATIVES (FR) 2017-06-14 EP disclosed
US-9579641-B2 Aryl phosphines with fused ring ortho-alkoxy substitution DOW GLOBAL TECHNOLOGIES LLC (US) 2017-02-28 US disclosed
US-20160184811-A1 ARYL PHOSPHINES WITH FUSED RING ORTHO-ALKOXY SUBSTITUTION DOW GLOBAL TECHNOLOGIES LLC (US) 2016-06-30 US disclosed
US-8188302-B2 Hydroamination of alkenes THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2012-05-29 US disclosed
US-20090156824-A1 Hydroamination of Alkenes BOARD OF TRUSTEES OF UNIVERSITY OF ILLINOIS (US) 2009-06-18 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 (4 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-20170166542-A1 Process for the Synthesis of Sulfones and Sulfonamides STS, SULT2A1, TST DRD1 2604/4885HTR2A 3129/4885
US-20090156824-A1 Hydroamination of Alkenes HRH3, HRH4, H1-3 DRD1 715/4885HTR2A 2025/4885
US-10173993-B2 Process for the synthesis of sulfones and sulfonamides STS, SULT2A1, TST DRD1 2604/4885HTR2A 3129/4885
US-20160184811-A1 ARYL PHOSPHINES WITH FUSED RING ORTHO-ALKOXY SUBSTITUTION ALK, PHOSPHO1, MPL DRD1 3012/4885HTR2A 1487/4885

“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.