SCHEMBL13490709

SCHEMBL13490709

CCc1c(C(=O)N[C@@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)[nH]c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
CNR1 P21554 2/20 0.42
CNR2 P34972 1/20 0.42
GID4 Q8IVV7 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CXCR6 O00574 1/20 0.41
USP30 Q70CQ3 1/20 0.41
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 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
Trifluoroacetic Acid SCHEMBL3209776 0.94 GID4 (0.40) POLBCNR1CNR2GID4SMN1; SMN2
SCHEMBL13490601 0.82 POLB (0.42) POLBGID4SMN1; SMN2CXCR6USP30
SCHEMBL13490680 0.82 ADORA1 (0.46) POLBSMN1; SMN2CXCR6
SCHEMBL13490630 0.80 SMYD3 (0.56) CNR2GID4SMN1; SMN2USP30
SCHEMBL13490676 0.80 SMN1; SMN2 (0.53) CNR1CNR2GID4SMN1; SMN2USP30
SCHEMBL14192814 0.80 SMN1; SMN2 (0.53) CNR1CNR2GID4SMN1; SMN2USP30
SCHEMBL13490654 0.79 SMN1; SMN2 (0.48) POLBGID4SMN1; SMN2USP30MAPT
Hydrochloric Acid SCHEMBL3224400 0.79 SMYD3 (0.55) CNR2GID4SMN1; SMN2USP30
SCHEMBL13490700 0.79 SMN1; SMN2 (0.49) CNR2GID4SMN1; SMN2USP30MAPT
SCHEMBL13490493 0.79 NPC1 (0.64) CNR1CNR2GID4SMN1; SMN2USP30

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-20100029615-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. 2010-02-04 US disclosed
US-20100029615-A1 BENZIMIDAZOLE DERIVATIVES PFIZER INC. 2010-02-04 US disclosed
WO-2008075196-A1 BENZIMIDAZOLE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-06-26 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-20100029615-A1 BENZIMIDAZOLE DERIVATIVES ACIN1, HAT1, CCNE1 POLB 3043/4885CNR1 1762/4885CNR2 2620/4885

“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.