SCHEMBL30455793

SCHEMBL30455793

O=C(Nc1ccc(OC(F)F)cc1)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.66
NPC1 O15118 8/20 0.64
RAB9A P51151 8/20 0.64
KMT2A Q03164 5/20 0.62
MEN1 O00255 4/20 0.62
RXFP1 Q9HBX9 1/20 0.62
PTPN1 P18031 2/20 0.59
ALOX15 P16050 1/20 0.58
GFER P55789 1/20 0.58
ADAM17 P78536 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
ALDH1A1 P00352 2/20 0.57
SIRT1 Q96EB6 1/20 0.57
KDM4E B2RXH2 1/20 0.57
POLB P06746 1/20 0.57
MAPT P10636 3/20 0.56
LMNA P02545 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 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
SCHEMBL19223060 0.85 KMT2A (0.73) PGRNPC1RAB9AKMT2AMEN1
SCHEMBL27179543 0.84 KMT2A (0.69) KMT2AMEN1SMN1; SMN2ALDH1A1POLB
SCHEMBL4111928 0.83 MAPT (0.68) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL4119062 0.83 MAPT (0.56) NPC1RAB9AKMT2AMEN1ALOX15
SCHEMBL12700358 0.83 ALDH1A1 (0.66) KMT2AMEN1GFERSMN1; SMN2ALDH1A1
SCHEMBL3714311 0.81 ALDH1A1 (0.66) KMT2AMEN1ALOX15GFERADAM17
SCHEMBL8361085 0.81 PGR (0.96) PGRNPC1RAB9AKMT2AMEN1
SCHEMBL126415 0.80 PTPN1 (0.87) PGRNPC1RAB9AKMT2AMEN1
SCHEMBL28758860 0.80 NPC1 (0.65) PGRNPC1RAB9AKMT2AMEN1
SCHEMBL5694520 0.80 PGR (1.00) PGRNPC1RAB9AKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12269814-B2 Process for preparing a compound useful to treat mycoses PULMOCIDE LIMITED (GB) 2025-04-08 US disclosed
US-11661415-B2 Process for preparing a compound useful to treat mycoses PULMOCIDE LIMITED (GB) 2023-05-30 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-11661415-B2 Process for preparing a compound useful to treat mycoses DPM1, CYP51A1, ERG28 PGR 1690/4885NPC1 713/4885RAB9A 1450/4885
US-12269814-B2 Process for preparing a compound useful to treat mycoses C1R, CBR1, CBR3 PGR 4121/4885NPC1 223/4885RAB9A 1340/4885

“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.