SCHEMBL3689149

SCHEMBL3689149

O=C(ON1C(=O)CCC1=O)c1ccc(CSCc2ccccc2)o1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 7/20 0.39
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
PKM P14618 1/20 0.39
TP53 P04637 2/20 0.39
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
BRCA1 P38398 1/20 0.38

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
SCHEMBL979643 0.84 PRSS1 (0.40) MAPTALDH1A1SMN1; SMN2TSHRKMT2A
SCHEMBL3685840 0.81 ALOX5 (0.43) POLBALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL26742181 0.77 KMT2A (0.38) LMNAMAPTALDH1A1SMN1; SMN2TSHR
SCHEMBL3682263 0.76 MAPT (0.49) LMNAPOLBMAPTALDH1A1SMN1; SMN2
SCHEMBL14387675 0.76 NPC1 (0.47) LMNAMAPTALDH1A1SMN1; SMN2TSHR
SCHEMBL11887838 0.75 POLB (0.68) LMNAPOLBMAPTALDH1A1TSHR
SCHEMBL3674345 0.74 ALDH1A1 (0.50) POLBMAPTALDH1A1SMN1; SMN2MAPK1
SCHEMBL3688463 0.72 HTT (0.61) LMNAALDH1A1SMN1; SMN2TSHRMAPK1
SCHEMBL3676358 0.71 MAPT (0.60) LMNAPOLBMAPTALDH1A1SMN1; SMN2
SCHEMBL10041303 0.71 LMNA (0.47) LMNAALDH1A1SMN1; SMN2MAPK1RAB9A

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-8410150-B2 Inhibitors of carnitine palmitoyltransferase and treating cancer UNIVERSITY HEALTH NETWORK (CA) 2013-04-02 US disclosed
US-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK 2010-04-29 US disclosed
WO-2008109991-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK (CA) 2008-09-18 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-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER CPT1A, CPT1B, CPT2 LMNA 2918/4885POLB 1534/4885MAPT 581/4885

“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.