SCHEMBL9968434

SCHEMBL9968434

CCCS(=O)(=O)N1CCN(c2cc(-c3nc4ccccc4n3C)c(F)cn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.48
HSD17B10 Q99714 2/20 0.48
GLA P06280 1/20 0.47
HSD11B1 P28845 3/20 0.42
KMT2A Q03164 1/20 0.42
SMO Q99835 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GAA P10253 3/20 0.41
TSHR P16473 1/20 0.41
USP2 O75604 1/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
DRD4 P21917 1/20 0.38
GRM2 Q14416 1/20 0.38
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GPR119 Q8TDV5 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
SCHEMBL9932768 0.94 KMT2A (0.47) KDM4EHSD17B10HSD11B1KMT2ASMO
SCHEMBL9932792 0.92 SMO (0.51) KDM4EHSD17B10GLAHSD11B1KMT2A
SCHEMBL1533860 0.90 SMO (0.50) KDM4EHSD17B10HSD11B1KMT2ASMO
SCHEMBL1533871 0.88 SMO (0.47) HSD11B1SMOSMN1; SMN2GAATSHR
SCHEMBL9931499 0.86 SMO (0.53) KDM4EHSD11B1KMT2ASMOSMN1; SMN2
SCHEMBL1533937 0.84 HSD11B1 (0.43) KDM4EHSD11B1KMT2ASMOSMN1; SMN2
SCHEMBL9932106 0.83 SMO (0.48) KDM4EHSD11B1KMT2ASMOSMN1; SMN2
SCHEMBL9932811 0.81 CKS1B (0.47) KDM4EKMT2ASMOGAAMAPT
SCHEMBL9932536 0.80 SMO (0.62) HSD17B10KMT2ASMOGAALMNA
SCHEMBL9931814 0.80 SMO (0.49) KDM4EHSD11B1SMOGAAMAPT

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-20120157471-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. (US) 2012-06-21 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-20120157471-A1 BENZIMIDAZOLE DERIVATIVES SMO, RB1, GLI1 KDM4E 258/4885HSD17B10 3995/4885GLA 2887/4885

“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.