SCHEMBL26231799

SCHEMBL26231799

Cc1cc(Cl)c2nnn(O)c2c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ POLB P06746 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ NT5E P21589 1/20 0.33
▸ CRHR1 P34998 2/20 0.32
▸ HRH4 Q9H3N8 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ GPR139 Q6DWJ6 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL3285305 0.73 MAPK1 (0.37) MAPK1MAPTPOLBATMPKM
SCHEMBL3279016 0.71 MAPT (0.50) MAPK1MAPTPOLBLMNAKDM4E
SCHEMBL3283730 0.71 MAPT (0.65) MAPK1MAPTRAB9ALMNAMEN1
SCHEMBL3280154 0.70 POLB (0.37) MAPK1MAPTPOLBATMPKM
SCHEMBL3283322 0.67 MGAM (0.42) MAPK1RAB9ANPC1POLBATM
SCHEMBL3285969 0.67 MGAM (0.42) MAPK1RAB9ANPC1POLBATM
SCHEMBL3283355 0.67 POLB (0.37) MAPK1MAPTPOLBATMPKM
SCHEMBL3279947 0.65 LMNA (0.40) MAPK1MAPTLMNAKDM4E
SCHEMBL23332543 0.64 F2RL3 (0.41) RAB9ANPC1POLBLMNAMEN1
SCHEMBL1305111 0.62 MAPK1 (0.37) MAPK1MAPTPOLBATMPKM

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-11760701-B2 Difluoromethoxylation and trifluoromethoxylation compositions and methods for synthesizing same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YROK (US) 2023-09-19 — — 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-11760701-B2 Difluoromethoxylation and trifluoromethoxylation compositions and methods for synthesizing same AFF2, AFF4, AFF1 MAPK1 4517/4885MAPT 2445/4885RAB9A 3109/4885

“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.

Send feedback