SCHEMBL12840478

SCHEMBL12840478

COc1ccc(-c2cnc(NC(=O)CCCc3ccccc3)c(-c3ccccc3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
POLB P06746 1/20 0.50
RAB9A P51151 4/20 0.48
FAAH O00519 1/20 0.48
KMT2A Q03164 1/20 0.46
TP53 P04637 1/20 0.46
PRKDC P78527 1/20 0.45
ATR Q13535 1/20 0.45
CNR1 P21554 1/20 0.45
NPC1 O15118 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PLAAT3 P53816 1/20 0.44
PLAAT5 Q96KN8 1/20 0.44
PLAAT2 Q9NWW9 1/20 0.44
PLAAT4 Q9UL19 1/20 0.44
ABL1 P00519 1/20 0.44
YES1 P07947 1/20 0.44
PIM1 P11309 1/20 0.44
MAPK1 P28482 1/20 0.44
HIPK1 Q86Z02 1/20 0.44

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
SCHEMBL12840429 0.95 ALDH1A1 (0.48) ALDH1A1POLBRAB9AFAAHKMT2A
SCHEMBL12840466 0.94 MAPK1 (0.48) RAB9AFAAHTP53PRKDCATR
SCHEMBL12839393 0.91 ALDH1A1 (0.51) ALDH1A1RAB9AKMT2ANPC1SMN1; SMN2
SCHEMBL12840428 0.89 CYP2C9 (0.46) ALDH1A1RAB9ATP53PRKDCATR
SCHEMBL12840050 0.89 ALDH1A1 (0.52) ALDH1A1POLBRAB9AFAAHKMT2A
SCHEMBL12838545 0.89 ALDH1A1 (0.46) ALDH1A1POLBRAB9AFAAHKMT2A
SCHEMBL12838933 0.88 ALDH1A1 (0.51) ALDH1A1POLBRAB9AFAAHKMT2A
SCHEMBL12840445 0.88 APP (0.56) ALDH1A1RAB9AKMT2APRKDCATR
SCHEMBL12839014 0.88 TRPV1 (0.54) ALDH1A1RAB9AFAAHKMT2APRKDC
SCHEMBL12839385 0.88 TRPV1 (0.54) ALDH1A1RAB9AFAAHKMT2APRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110070656-A1 Fluorescent Proteins JNC CORPORATION (JP) 2011-03-24 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-20110070656-A1 Fluorescent Proteins CACYBP, CHLSN, LCP2 ALDH1A1 4516/4885POLB 3291/4885RAB9A 2980/4885

“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.