SCHEMBL3493936

SCHEMBL3493936

O=c1[nH]c(Cc2c(Cl)cccc2Cl)nc2c(-c3cccnc3)n[nH]c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PTGES O14684 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ TYMP P19971 1/20 0.39
▸ PDE7A Q13946 1/20 0.39
▸ PIM1 P11309 5/20 0.37
▸ LCK P06239 1/20 0.37
▸ BTK Q06187 1/20 0.37
▸ CLK2 P49760 4/20 0.36
▸ CLK3 P49761 4/20 0.36
▸ DYRK1A Q13627 4/20 0.36
▸ IDO1 P14902 1/20 0.36
▸ LRRK2 Q5S007 1/20 0.36
▸ AR P10275 1/20 0.36
▸ PNP P00491 1/20 0.36
▸ PIM2 Q9P1W9 1/20 0.35
▸ TAAR1 Q96RJ0 1/20 0.34

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
SCHEMBL6368276 0.87 PIM1 (0.39) PIM1BTKCLK2CLK3DYRK1A
SCHEMBL6372415 0.85 PDE5A (0.52) PNP
SCHEMBL6371898 0.78 IDO1 (0.40) PIM1BTKCLK2CLK3DYRK1A
SCHEMBL3494974 0.78 AR (0.41) KMT2APIM1BTKCLK2CLK3
SCHEMBL6372381 0.77 NTRK1 (0.41) KMT2APIM1BTKCLK2CLK3
SCHEMBL6371987 0.76 PDE9A (0.40) KMT2APIM1BTKIDO1LRRK2
SCHEMBL6366070 0.76 PDE9A (0.44) KMT2ACLK2CLK3DYRK1AIDO1
SCHEMBL3492777 0.76 PDE9A (0.54) KMT2ABTKCLK2CLK3DYRK1A
SCHEMBL6367719 0.75 CACNA1H (0.39) KMT2APIM1CLK2CLK3DYRK1A
SCHEMBL3493363 0.75 PDE9A (0.55) MEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100113484-A1 TREATING AGENT OF UROPATHY ASKA PHARMACEUTICAL CO., LTD. (JP) 2010-05-06 — — US disclosed
EP-2123301-A1 THERAPEUTIC AGENT FOR URINARY TRACT DISEASE ASKA Pharmaceutical Co., Ltd. (JP) 2009-11-25 — — EP disclosed
US-6967204-B2 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER INC (US) 2005-11-22 — — US disclosed
US-20050070557-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors PFIZER INC 2005-03-31 — — 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 (2 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-20100113484-A1 TREATING AGENT OF UROPATHY BPHL, PDE12, UROD MEN1 3598/4885KMT2A 2820/4885PTGES 410/4885
US-20050070557-A1 Treatment of insulin resistance syndrome and type 2 diabetes with PDE9 inhibitors GPR119, PDE2A, PDE9A MEN1 1265/4885KMT2A 2168/4885PTGES 600/4885

“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.

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