SCHEMBL22926425

SCHEMBL22926425

O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1cccnc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 6/20 1.00
▸ NPC1 O15118 5/20 1.00
▸ EPHX2 P34913 4/20 0.69
▸ KDM4E B2RXH2 1/20 0.68
▸ MAPT P10636 1/20 0.64
▸ PKM P14618 1/20 0.64
▸ MEN1 O00255 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ KDR P35968 1/20 0.60
▸ ABL1 P00519 4/20 0.60
▸ OPRM1 P35372 1/20 0.60
▸ KCNH2 Q12809 1/20 0.60
▸ L3MBTL1 Q9Y468 2/20 0.59
▸ CYP1A2 P05177 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ FAAH O00519 1/20 0.56

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
SCHEMBL12978270 0.85 RAB9A (0.74) RAB9ANPC1EPHX2KMT2AABL1
SCHEMBL16692450 0.84 NPC1 (0.72) RAB9ANPC1EPHX2KDM4EMAPT
SCHEMBL22103767 0.84 EPHX2 (0.86) RAB9ANPC1EPHX2MAPTMEN1
SCHEMBL11555827 0.83 EPHX2 (1.00) RAB9ANPC1EPHX2MAPTMEN1
SCHEMBL1305523 0.83 RAB9A (0.70) RAB9ANPC1EPHX2KDM4EMAPT
SCHEMBL20379482 0.82 NAMPT (0.71) RAB9ANPC1MEN1KMT2AL3MBTL1
SCHEMBL6122991 0.82 ABL1 (0.76) RAB9ANPC1KMT2AABL1OPRM1
SCHEMBL30772272 0.81 EPHX2 (0.87) RAB9ANPC1EPHX2KDM4EMEN1
SCHEMBL17074387 0.81 NPC1 (0.68) RAB9ANPC1EPHX2KDM4EMAPT
SCHEMBL9637653 0.80 MEN1 (0.77) RAB9ANPC1KDM4EMAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210022340-A1 USE OF PYRIDINE UREA COMPOUND HAVING SNAIL-KILLING ACTIVITY THE NATIONAL INSTITUTE OF PARASITIC DISEASES, CHINESE CENTER FOR DISEASE CONTROL AND PREVENTION (CN) 2021-01-28 — — 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-20210022340-A1 USE OF PYRIDINE UREA COMPOUND HAVING SNAIL-KILLING ACTIVITY SLC14A1, UACA, UROD RAB9A 1093/4885NPC1 1905/4885EPHX2 2107/4885

“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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