SCHEMBL25337572

SCHEMBL25337572

Cc1ccc(C(=O)Cl)cc1C=O.Cc1ccc(C(=O)Nc2cccc(OC(F)(F)F)c2)cc1C=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ GPR142 Q7Z601 1/20 0.49
▸ P2RX1 P51575 1/20 0.48
▸ BRAF P15056 3/20 0.47
▸ RAF1 P04049 1/20 0.47
▸ MAPT P10636 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ KCNK3 O14649 1/20 0.46
▸ KCNK9 Q9NPC2 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ NAMPT P43490 1/20 0.46
▸ CSF1R P07333 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL24071023 0.95 NPC1 (0.61) NPC1RAB9AGPR142P2RX1BRAF
SCHEMBL30211942 0.83 NPC1 (0.59) NPC1RAB9AP2RX1BRAFMAPT
SCHEMBL24070620 0.83 NPC1 (0.59) NPC1RAB9AP2RX1BRAFMAPT
SCHEMBL25949228 0.81 RXFP1 (0.67) NPC1RAB9AALDH1A1HTTKCNK3
SCHEMBL2107071 0.81 NPC1 (0.58) NPC1RAB9AP2RX1BRAFMAPT
SCHEMBL22025463 0.79 NPC1 (0.63) NPC1RAB9AGPR142P2RX1BRAF
SCHEMBL22065214 0.78 NPC1 (0.62) NPC1RAB9AGPR142P2RX1BRAF
SCHEMBL24070816 0.78 MAPT (0.65) RAB9AP2RX1MAPTHTTKCNK3
SCHEMBL30211957 0.78 MAPT (0.65) RAB9AP2RX1MAPTHTTKCNK3
SCHEMBL2105853 0.78 NPC1 (0.67) NPC1RAB9AP2RX1BRAFMAPT

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-20230227447-A1 BENZYLAMINE DERIVATIVES AS DDRS INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2023-07-20 — — 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-20230227447-A1 BENZYLAMINE DERIVATIVES AS DDRS INHIBITORS DDR2, DDR1, DDRGK1 NPC1 2973/4885RAB9A 2278/4885GPR142 2626/4885

“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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