SCHEMBL3934432

SCHEMBL3934432

CCOC(=O)c1ccc(NC(=O)N(CCc2ccccc2)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
NAMPT P43490 1/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
GAA P10253 2/20 0.48
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP2D6 P10635 1/20 0.48
ALOX12 P18054 1/20 0.48
SENP1 Q9P0U3 1/20 0.47
RARA P10276 2/20 0.45
RARB P10826 2/20 0.45
RARG P13631 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45

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
SCHEMBL3931570 0.89 RARB (0.56) MEN1KMT2AALDH1A1CYP1A2CYP3A4
SCHEMBL6337777 0.88 SMN1; SMN2 (0.47) MAPTNAMPTSMN1; SMN2MEN1KMT2A
SCHEMBL6343404 0.87 SMN1; SMN2 (0.47) MAPTNAMPTSMN1; SMN2MEN1KMT2A
SCHEMBL6337770 0.86 SMN1; SMN2 (0.46) MAPTNAMPTSMN1; SMN2MEN1KMT2A
SCHEMBL3933288 0.80 CYP3A4 (0.47) MAPTNAMPTMEN1KMT2AALDH1A1
SCHEMBL3932216 0.80 CYP3A4 (0.52) MAPTMEN1KMT2AALDH1A1CYP1A2
SCHEMBL3937033 0.79 RXRA (0.54) MEN1KMT2AALDH1A1CYP1A2CYP3A4
SCHEMBL3934121 0.79 RARB (0.58) MEN1KMT2AALDH1A1GAACYP1A2
SCHEMBL6342047 0.78 RXRA (0.57) MEN1KMT2AALDH1A1CYP1A2CYP3A4
SCHEMBL6335047 0.77 RXRA (0.56) MEN1KMT2AALDH1A1CYP1A2CYP3A4

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
EP-1430023-B1 SUBSTITUIED UREA RETINOID AGONISTS II HOFFMANN LA ROCHE (CH) 2009-04-08 EP disclosed
US-6838472-B2 For treating or preventing emphysema, cancer and dermatological disorders SYNTEX (U.S.A.) LLC (US) 2005-01-04 US disclosed
EP-1430023-A1 SUBSTITUIED UREA RETINOID AGONISTS II F. HOFFMANN-LA ROCHE AG (CH) 2004-06-23 EP disclosed
US-20030125383-A1 Substituted urea retinoid agonists ROCHE BIOSCIENCE, A DIVISION OF SYNTEX (U.S.A.) LLC 2003-07-03 US disclosed
WO-2003024920-A1 SUBSTITUTED UREA RETINOID AGONISTS II F. HOFFMANN-LA ROCHE AG (CH) 2003-03-27 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-20030125383-A1 Substituted urea retinoid agonists RXRA, RXRG, RARG MAPT 1872/4885NAMPT 447/4885SMN1; SMN2 3225/4885

“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.