SCHEMBL9932110

SCHEMBL9932110

Cn1c(-c2cccc(N3CCN(S(C)(=O)=O)CC3)n2)nc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.48
NPSR1 Q6W5P4 2/20 0.47
NPC1 O15118 1/20 0.47
TSHR P16473 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
METAP2 P50579 1/20 0.44
METAP1 P53582 1/20 0.44
SMO Q99835 2/20 0.44
KDR P35968 1/20 0.43
PTK2 Q05397 1/20 0.43
PIK3CD O00329 1/20 0.43
PIK3R1 P27986 1/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
GRM2 Q14416 1/20 0.41

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
SCHEMBL9968418 0.91 HSD11B1 (0.47) HSD11B1NPSR1NPC1TSHRRAB9A
SCHEMBL9932626 0.83 HSD11B1 (0.48) HSD11B1NPSR1NPC1TSHRRAB9A
SCHEMBL9932137 0.82 LMNA (0.51) HSD11B1NPSR1NPC1TSHRRAB9A
SCHEMBL9932520 0.81 MEN1 (0.48) NPC1RAB9ASMN1; SMN2METAP2METAP1
SCHEMBL9932249 0.81 HSD11B1 (0.48) HSD11B1NPSR1NPC1TSHRRAB9A
SCHEMBL1533907 0.81 HTR3A (0.49) METAP2METAP1KDRPTK2KMT2A
SCHEMBL12841343 0.79 METAP2 (0.44) HSD11B1NPC1RAB9ASMN1; SMN2METAP2
SCHEMBL9968417 0.79 METAP2 (0.44) NPC1RAB9ASMN1; SMN2METAP2METAP1
SCHEMBL9931983 0.79 KMT2A (0.46) NPSR1NPC1TSHRRAB9ASMN1; SMN2
SCHEMBL9931365 0.79 ALDH1A1 (0.48) NPSR1SMN1; SMN2METAP2METAP1SMO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US disclosed
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US disclosed
US-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 US disclosed
WO-2011027249-A2 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2011-03-10 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-20120157471-A1 BENZIMIDAZOLE DERIVATIVES SMO, RB1, GLI1 HSD11B1 3610/4885NPSR1 3961/4885NPC1 3570/4885

“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.