SCHEMBL4988089

SCHEMBL4988089

Cc1nc2cc(C(=O)Nc3ccc(C4CCCCC4)cc3)ccc2s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.56
RAB9A P51151 7/20 0.56
NPC1 O15118 6/20 0.56
HDAC3 O15379 1/20 0.55
HDAC11 Q96DB2 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
DEGS1 O15121 1/20 0.55
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
LMNA P02545 1/20 0.53
CHRNA7 P36544 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
RPS6KA2 Q15349 1/20 0.49
HDAC4 P56524 1/20 0.49
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
CASP3 P42574 1/20 0.48
SENP7 Q9BQF6 1/20 0.48

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
SCHEMBL4984310 0.80 TRPV1 (0.65) TRPV1RAB9ANPC1MEN1KMT2A
SCHEMBL5128348 0.79 TRPV1 (0.68) TRPV1HDAC3HDAC11HDAC8HDAC6
SCHEMBL4988297 0.78 TRPV1 (0.88) TRPV1RAB9ANPC1HDAC3HDAC11
SCHEMBL4986940 0.78 TRPV1 (0.62) TRPV1RAB9ANPC1HDAC3HDAC8
SCHEMBL4900109 0.78 TRPV1 (0.56) TRPV1RAB9ANPC1MEN1KMT2A
SCHEMBL24445076 0.78 HDAC4 (0.48) RAB9ANPC1KMT2ACHRNA7SMN1; SMN2
SCHEMBL24444427 0.78 HDAC4 (0.48) RAB9ANPC1KMT2ACHRNA7SMN1; SMN2
SCHEMBL4987540 0.77 TRPV1 (0.71) TRPV1RAB9ANPC1MEN1KMT2A
SCHEMBL16022191 0.76 HDAC8 (0.76) RAB9ANPC1HDAC3HDAC11HDAC8
SCHEMBL5781167 0.76 TRPV1 (0.72) TRPV1RAB9ANPC1MEN1KMT2A

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-20080108676-A1 Benzothiazolecarboxamides NEW BENZOTHIAZOLECARBOXAMIDES (SE) 2008-05-08 US claimed
US-20080108676-A1 Benzothiazolecarboxamides NEW BENZOTHIAZOLECARBOXAMIDES (SE) 2008-05-08 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-20080108676-A1 Benzothiazolecarboxamides QDPR, NDUFB5, NDUFB6 TRPV1 356/4885RAB9A 3886/4885NPC1 1580/4885

“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.