SCHEMBL8739288

SCHEMBL8739288

CC1(C)C[C@@H](N)C[C@@](C)(CN)C1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL19217559 1.00 ALDH1A1 (0.33) ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL21147091 1.00 ALDH1A1 (0.33) ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL20604028 1.00 ALDH1A1 (0.33) ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL18473954 1.00 ALDH1A1 (0.33) ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL15383 1.00 ALDH1A1 (0.33) ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL8739143 1.00 ALDH1A1 (0.33) ALDH1A1CYP3A4MEN1KMT2A
Ammonia Solution, Strong SCHEMBL7183446 0.98 ALDH1A1 (0.33) ALDH1A1CYP3A4MEN1KMT2A
Hydrochloric Acid SCHEMBL9228552 0.98 MEN1 (0.35) ALDH1A1CYP3A4MEN1KMT2A
Ethylenediamine SCHEMBL10381584 0.96 ALDH1A1 (0.32) ALDH1A1CYP3A4MEN1KMT2A
SCHEMBL7189601 0.94 ALDH1A1 (0.31) ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2115026-B1 AMINE-INITIATED POLYOLS AND RIGID POLYURETHANE FOAM MADE THEREFROM DOW GLOBAL TECHNOLOGIES LLC (US) 2018-05-02 EP disclosed
US-8193257-B2 Amine-initiated polyols and rigid polyurethane foam made therefrom DOW GLOBAL TECHNOLOGIES LLC (US) 2012-06-05 US disclosed
US-8193257-B2 Amine-initiated polyols and rigid polyurethane foam made therefrom DOW GLOBAL TECHNOLOGIES LLC (US) 2012-06-05 US disclosed
US-20120129964-A1 Amine-initiated polyols and rigid polyurethane foam made therefrom MORLEY TIMOTHY A (CH) 2012-05-24 US disclosed
US-20100036010-A1 Amine-initiated polyols and rigid polyurethane foam made therefrom DOW GLOBAL TECHNOLOGIES LLC 2010-02-11 US disclosed
US-20100036010-A1 Amine-initiated polyols and rigid polyurethane foam made therefrom DOW GLOBAL TECHNOLOGIES LLC 2010-02-11 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-20100036010-A1 Amine-initiated polyols and rigid polyurethane foam made therefrom PKM, PUF60, PNMT ALDH1A1 3866/4885CYP3A4 4222/4885MEN1 1589/4885

“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.