SCHEMBL6332500

SCHEMBL6332500

CCCc1nn(Cc2ccccc2)c(C(N)=O)c1NC(=O)c1cc(S(=O)(=O)N2CCN(C)CC2)ccc1OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.52
MEN1 O00255 3/20 0.52
POLB P06746 1/20 0.50
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
TERT O14746 1/20 0.43
PDE5A O76074 8/20 0.42
ABCC4 O15439 2/20 0.42
PDE3B Q13370 2/20 0.42
PDE3A Q14432 2/20 0.42
PDE1A P54750 2/20 0.42
PDE1B Q01064 2/20 0.42
PDE1C Q14123 2/20 0.42
PDE2A O00408 1/20 0.42
ABCC5 O15440 1/20 0.42
PDE6D O43924 1/20 0.42
PDE8A O60658 1/20 0.42
PDE9A O76083 1/20 0.42
ABCB11 O95342 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL7002737 0.90 KMT2A (0.53) KMT2AMEN1POLBPDE5ALMNA
SCHEMBL4565717 0.88 TERT (0.56) KMT2AMEN1POLBCA12CA9
SCHEMBL6207835 0.81 TERT (0.65) KMT2AMEN1CA12CA9TERT
SCHEMBL6201352 0.79 KMT2A (0.51) KMT2AMEN1POLBCA12CA9
SCHEMBL6207634 0.79 TERT (0.53) KMT2ATERTCYP3A4LMNATSHR
SCHEMBL3581108 0.77 PDE5A (0.53) KMT2AMEN1POLBCA12CA9
SCHEMBL4563385 0.77 TERT (0.53) KMT2AMEN1POLBCA12CA9
SCHEMBL8125815 0.77 TERT (0.62) KMT2ATERTPDE5APDE3BPDE3A
SCHEMBL6197854 0.77 KMT2A (0.55) KMT2AMEN1POLBCA12CA9
SCHEMBL6492024 0.77 TERT (0.53) KMT2AMEN1CA12CA9TERT

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-6916927-B2 Pyrazolopyrimidinones which inhibit type 5 cyclic guanosine 3′,5′-monophosphate phosphodiesterase (cGMP-PDE5) for the treatment of sexual dysfunction PFIZER INC. 2005-07-12 US disclosed
US-20040180944-A1 Pyrazolopyrimidinones which inhibit type 5 cyclic guanosine 3',5'-monophosphate phosphodiesterase (cGMP-PDE5) for the treatment of sexual dysfunction PFIZER INC 2004-09-16 US disclosed
US-6723719-B1 DYSMENORRHOEA, BENIGN PROSTATIC HYPERPLASIA (BPH), BLADDER OUTLET OBSTRUCTION, INCONTINENCE, AGINA, CONGESTIVE HEART FAILURE, ATHEROSCLEROSIS; HYPOTENSIVE AND ANTIALLERGEN AGENTS PFIZER INC 2004-04-20 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-20040180944-A1 Pyrazolopyrimidinones which inhibit type 5 cyclic guanosine 3',5'-monophosphate phosphodiesterase (cGMP-PDE5) for the treatment of sexual dysfunction PDE5A, PDE3A, PDE3B KMT2A 4191/4885MEN1 4470/4885POLB 2681/4885

“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.