SCHEMBL8901288

SCHEMBL8901288

CNC(=O)Nc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
PGR P06401 1/20 0.62
MAPK1 P28482 1/20 0.61
CA12 O43570 2/20 0.60
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA9 Q16790 2/20 0.60
NPC1 O15118 1/20 0.59
CRHBP P24387 1/20 0.59
RAB9A P51151 1/20 0.59
CRHR2 Q13324 1/20 0.59
NPY5R Q15761 1/20 0.58
TGM2 P21980 1/20 0.58
RNF4 P78317 1/20 0.58
EPHX1 P07099 2/20 0.58
GCK P35557 1/20 0.57
ALDH1A1 P00352 1/20 0.57
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56

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
SCHEMBL30053559 0.89 CA12 (0.73) HPGDSMN1; SMN2PGRMAPK1CA12
SCHEMBL12362185 0.87 ALDH1A1 (0.56) HPGDSMN1; SMN2MAPK1NPC1RAB9A
SCHEMBL21295380 0.87 CA12 (0.71) HPGDSMN1; SMN2PGRMAPK1CA12
SCHEMBL11828386 0.86 MMP13 (0.59) HPGDSMN1; SMN2MAPK1NPC1RAB9A
SCHEMBL11837483 0.86 KMT2A (0.59) SMN1; SMN2MAPK1CA1CA2CA9
SCHEMBL11211518 0.85 MEN1 (0.60) HPGDSMN1; SMN2MAPK1CA12CA1
SCHEMBL11338762 0.85 GPR174 (0.56) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL11838623 0.84 ALDH1A1 (0.79) SMN1; SMN2MAPK1CA12CA1CA2
SCHEMBL21295574 0.84 NPC1 (0.76) HPGDSMN1; SMN2PGRMAPK1CA12
SCHEMBL12994776 0.84 HPGD (0.65) HPGDSMN1; SMN2PGRMAPK1CA12

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
WO-2018103058-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHODS OF THEIR USE JANSSEN PHARMACEUTICA NV (BE) 2018-06-14 WO disclosed
US-9187470-B2 Anti-mucus drugs and uses therefor WASHINGTON UNIVERSITY (US) 2015-11-17 US disclosed
US-20150183777-A1 ANTI-MUCUS DRUGS AND USES THEREFOR NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-07-02 US disclosed
EP-0777471-A1 INHIBITION OF LEUKOTRIENE BIOSYNTHESIS WITH UREA DERIVATIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-06-11 EP disclosed
WO-1996003983-A1 INHIBITION OF LEUKOTRIENE BIOSYNTHESIS WITH UREA DERIVATIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-02-15 WO disclosed
US-3933814-A ANTIPROTOZOA, ANTICOCCIDIOSIS BAYER AKTIENGESELLSCHAFT (DT) 1976-01-20 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-20150183777-A1 ANTI-MUCUS DRUGS AND USES THEREFOR MAPK13, MAPK11, MUC1 HPGD 113/4885SMN1; SMN2 4868/4885PGR 293/4885

“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.