SCHEMBL15134753

SCHEMBL15134753

CCc1noc(-c2ccncc2)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.61
NPC1 O15118 10/20 0.61
SMN1; SMN2 Q16637 7/20 0.61
MAPT P10636 6/20 0.61
ALDH1A1 P00352 5/20 0.61
TP53 P04637 4/20 0.61
LMNA P02545 2/20 0.61
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
S1PR1 P21453 6/20 0.51
NPSR1 Q6W5P4 2/20 0.51
NFKB1 P19838 2/20 0.51
NFKB2 Q00653 2/20 0.51
RELA Q04206 2/20 0.51
HPGD P15428 3/20 0.50
HSD17B10 Q99714 3/20 0.50
PKM P14618 2/20 0.50
S1PR3 Q99500 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TSHR P16473 1/20 0.49

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
SCHEMBL11968692 0.86 NPC1 (0.69) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL91656 0.83 SMN1; SMN2 (0.70) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL1696225 0.81 NPC1 (0.53) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL4668238 0.81 RAB9A (0.54) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL10053916 0.81 MAPT (0.57) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL11955106 0.81 RAB9A (0.53) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL23360754 0.80 SMN1; SMN2 (0.49) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL19627022 0.80 NOTUM (0.70) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL9197723 0.80 NPC1 (0.53) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL10081939 0.80 LMNA (0.57) RAB9ANPC1SMN1; SMN2MAPTALDH1A1

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-8895580-B2 Quinolinone-pyrazolone M1 receptor positive allosteric modulators MERCK SHARP & DOHME CORP. (US) 2014-11-25 US disclosed
US-20130190323-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE MEDIVATION TECHNOLOGIES, INC. (US) 2013-07-25 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-20130190323-A1 PYRIDO[3,4-B]INDOLES AND METHODS OF USE HTR3B, HTR4, HTR2C RAB9A 1487/4885NPC1 3670/4885SMN1; SMN2 2604/4885

“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.