SCHEMBL15928296

SCHEMBL15928296

C=C(C)c1nc(C)c(OC)cc1F

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
PRNP P04156 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SMPD3 Q9NY59 1/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
CYP1A2 P05177 1/20 0.31
P2RX7 Q99572 1/20 0.31
GLA P06280 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL14214503 0.80 SMPD3 (0.38) ALDH1A1MAPTKDM4EKMT2ASMN1; SMN2
SCHEMBL20780322 0.79 SMPD3 (0.35) KMT2ASMN1; SMN2SMPD3
SCHEMBL13394707 0.79 KMT2A (0.35) KMT2ASMN1; SMN2LMNAMTNR1AMTNR1B
SCHEMBL27752610 0.75 ALDH1A1 (0.43) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL10244696 0.71 ALDH1A1 (0.40) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL15928286 0.68 ALDH1A1 (0.38) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL31062981 0.67 HTT (0.38) LMNAMAPK1HTTRAB9AMTNR1A
SCHEMBL12062742 0.66 KDM4E (0.62) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL15099897 0.66 KDM4E (0.37) ALDH1A1MAPTKDM4EL3MBTL1KMT2A
SCHEMBL19364027 0.66 KMT2A (0.34) ALDH1A1MAPTKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210290623-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS DALCOR PHARMA UK LTD., LEATHERHEAD, ZUG BRANCH (CH) 2021-09-23 US disclosed
US-20200222406-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS DALCOR PHARMA UK LTD., STOCKPORT ZUG BRANCH (CH) 2020-07-16 US disclosed
US-20140221383-A1 CETP INHIBITORS MERCK SHARP & DOHME CORP. (US) 2014-08-07 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 (3 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-20140221383-A1 CETP INHIBITORS CETP, APOB, MTTP ALDH1A1 3887/4885MAPT 3011/4885PRNP 3574/4885
US-20200222406-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS HMGCR, PCSK9, FABP3 ALDH1A1 1235/4885MAPT 3073/4885PRNP 3189/4885
US-20210290623-A1 METHODS FOR TREATING OR PREVENTING CARDIOVASCULAR DISORDERS AND LOWERING RISK OF CARDIOVASCULAR EVENTS HMGCR, PCSK9, FABP3 ALDH1A1 1235/4885MAPT 3073/4885PRNP 3189/4885

“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.