SCHEMBL14937482

SCHEMBL14937482

CC(=O)Nc1ccc(Cl)c(OCCOc2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.53
RORC P51449 3/20 0.52
GRM4 Q14833 1/20 0.51
RAB9A P51151 3/20 0.50
ESRRA P11474 2/20 0.50
POLB P06746 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.48
LMNA P02545 2/20 0.48
PKM P14618 1/20 0.48
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48
TP53 P04637 1/20 0.47

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
SCHEMBL14937737 0.85 POLB (0.51) NPC1RAB9APOLBMEN1KMT2A
SCHEMBL14937917 0.84 TNF (0.54) NPC1RAB9APOLBMEN1KMT2A
SCHEMBL14937407 0.82 RORC (0.56) RORCGRM4ESRRAPOLBMEN1
SCHEMBL14544527 0.81 ALDH1A1 (0.71) NPC1RAB9APOLBMEN1KMT2A
SCHEMBL14937652 0.80 UTS2R (0.54) RORCGRM4ESRRAMEN1KMT2A
SCHEMBL14937146 0.79 FAAH (0.48) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL14937582 0.78 RORC (0.57) RORCGRM4ESRRAMEN1KMT2A
SCHEMBL17601202 0.76 EGFR (0.63) NPC1RORCGRM4RAB9ASMN1; SMN2
SCHEMBL30623172 0.76 EGFR (0.63) NPC1RORCGRM4RAB9ASMN1; SMN2
SCHEMBL9730182 0.75 GRM4 (0.61) RORCGRM4ESRRAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877752-B2 4(1H)-quinolones having antimalarial activity with reduced chemical resistance UNIVERSITY OF SOUTH FLORIDA (US) 2014-11-04 US disclosed
US-20130123258-A1 4(1H)-Quinolones Having Antimalarial Activity With Reduced Chemical Resistance NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-05-16 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-20130123258-A1 4(1H)-Quinolones Having Antimalarial Activity With Reduced Chemical Resistance CDC25C, ABCC1, CDC25A NPC1 2324/4885RORC 880/4885GRM4 2598/4885

“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.