SCHEMBL7564384

SCHEMBL7564384

COc1ccc(CNC(=O)c2cc(C#N)ccc2N[C@H]2CCN(S(C)(=O)=O)C2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.49
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.43
TP53 P04637 3/20 0.42
TNF P01375 1/20 0.42
MAPT P10636 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.42
PDE5A O76074 2/20 0.41
GAA P10253 1/20 0.41
MEN1 O00255 1/20 0.40
MMP2 P08253 1/20 0.40
MMP13 P45452 1/20 0.40
ACHE P22303 1/20 0.40
BACE1 P56817 1/20 0.40
APEX1 P27695 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
SCHEMBL7568895 1.00 RAB9A (0.49) RAB9AKMT2AALDH1A1POLBTP53
SCHEMBL7568886 1.00 RAB9A (0.49) RAB9AKMT2AALDH1A1POLBTP53
SCHEMBL7563845 0.95 RAB9A (0.54) RAB9AKMT2AALDH1A1POLBTP53
SCHEMBL7564933 0.95 RAB9A (0.47) RAB9AKMT2AALDH1A1POLBTP53
SCHEMBL7565516 0.94 ALDH1A1 (0.44) RAB9AKMT2AALDH1A1POLBTP53
SCHEMBL7565523 0.94 ALDH1A1 (0.44) RAB9AKMT2AALDH1A1POLBTP53
SCHEMBL7565390 0.88 ACHE (0.45) ALDH1A1TNFIRAK4PDE5AMMP2
SCHEMBL7565400 0.88 ACHE (0.45) ALDH1A1TNFIRAK4PDE5AMMP2
SCHEMBL7598322 0.88 ACHE (0.45) ALDH1A1TNFIRAK4PDE5AMMP2
SCHEMBL7564208 0.87 ACHE (0.45) KMT2AALDH1A1IRAK4MEN1MMP2

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-20020193614-A1 Anthranilic acid derivatives as inhibitors of the CGMP-phosphodiesterase FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-12-19 US disclosed
US-6384080-B1 TREATMENT AND/OR PREVENTION OF CERTAIN CARDIOVASCULAR DISORDERS, UROGENITAL DISORDERS, RESPIRATORY SYSTEM DISORDERS, DISORDERS OF GUT MOTILITY, SEXUAL DISORDERS, DIABETIC COMPLICATIONS, URTICARIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-05-07 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-20020193614-A1 Anthranilic acid derivatives as inhibitors of the CGMP-phosphodiesterase PDE3A, PDE2A, PDE5A RAB9A 1299/4885KMT2A 1991/4885ALDH1A1 253/4885

“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.