SCHEMBL102151

SCHEMBL102151

Cc1nc(-c2ccc([C@H]3CN(C(=O)Oc4ccccc4)CCO3)cc2)no1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.45
LMNA P02545 2/20 0.45
TSHR P16473 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
DRD3 P35462 2/20 0.44
DRD2 P14416 1/20 0.44
KCNH2 Q12809 1/20 0.44
KMT2A Q03164 3/20 0.42
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GPR119 Q8TDV5 1/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
P2RX3 P56373 1/20 0.41
TACR3 P29371 2/20 0.40
MGLL Q99685 1/20 0.40
DGAT1 O75907 2/20 0.40

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
SCHEMBL966656 0.86 DRD3 (0.49) RAB9ALMNATSHRNFKB1NFKB2
SCHEMBL967405 0.84 GPR119 (0.58) DRD3DRD2KCNH2GPR119TACR3
SCHEMBL102402 0.79 DRD3 (0.49) RAB9ALMNATSHRNFKB1NFKB2
SCHEMBL2296709 0.78 KMT2A (0.47) RAB9AKMT2ANPC1SMN1; SMN2KDM4E
SCHEMBL2291811 0.78 KMT2A (0.47) RAB9ATSHRKMT2ANPC1SMN1; SMN2
SCHEMBL2298185 0.78 KMT2A (0.47) RAB9AKMT2ANPC1SMN1; SMN2KDM4E
SCHEMBL2298826 0.78 KMT2A (0.47) RAB9ATSHRKMT2ANPC1SMN1; SMN2
SCHEMBL2297714 0.78 ALOX15 (0.53) RAB9AKMT2ANPC1SMN1; SMN2KDM4E
SCHEMBL2299966 0.78 ALOX15 (0.53) RAB9AKMT2ANPC1SMN1; SMN2KDM4E
SCHEMBL2297540 0.76 KMT2A (0.46) RAB9AKMT2ANPC1SMN1; SMN2KDM4E

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-20120059165-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF SANOFI (FR) 2012-03-08 US disclosed
US-20120059165-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF SANOFI (FR) 2012-03-08 US disclosed
WO-2010104193-A2 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-16 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-20120059165-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF HRH4, HNMT, CYP3A4 RAB9A 1796/4885LMNA 2935/4885TSHR 510/4885

“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.