SCHEMBL21777474

SCHEMBL21777474

COC(=O)C(Oc1c(Br)cc(F)cc1Br)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
GAA P10253 1/20 0.33
SLC6A3 Q01959 1/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
FOLH1 Q04609 2/20 0.32
HTR2A P28223 1/20 0.32
CA12 O43570 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA14 Q9ULX7 1/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TPMT P51580 1/20 0.31
TTR P02766 1/20 0.30
APOBEC3A P31941 1/20 0.30
HTT P42858 1/20 0.30
APOBEC3G Q9HC16 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
SCHEMBL21777475 1.00 KMT2A (0.33) KMT2AMEN1GAASLC6A3MAPT
SCHEMBL14092208 0.79 FFAR1 (0.39) KMT2AMEN1GAAMAPTHPGD
SCHEMBL20681094 0.73 SLC6A3 (0.37) KMT2AMEN1GAASLC6A3MAPT
SCHEMBL27082310 0.72 CA2 (0.34) HTR2A
SCHEMBL18330989 0.70 LDHA (0.50) KMT2AMEN1GAAMAPTSMN1; SMN2
SCHEMBL14092212 0.70 LMNA (0.42) KMT2ATSHR
SCHEMBL21787511 0.69 TRPA1 (0.33) HTR2A
SCHEMBL21777352 0.69 TRPA1 (0.33) HTR2A
SCHEMBL21057237 0.68 MMP1 (0.35) KMT2AMAPTHSD17B10SMN1; SMN2HTT
SCHEMBL21057236 0.68 MMP1 (0.35) KMT2AMAPTHSD17B10SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3843728-B1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC INC (US) 2025-04-30 EP disclosed
US-20230219949-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC, INC. 2023-07-13 US disclosed
EP-3843728-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN Morphic Therapeutic, Inc. (US) 2021-07-07 EP disclosed
WO-2020047207-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTICS, INC. (US) 2020-03-05 WO disclosed
WO-2020047207-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTICS, INC. (US) 2020-03-05 WO 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-20230219949-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN ITGB6, ITGA6, ITGAV KMT2A 3926/4885MEN1 3154/4885GAA 388/4885

“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.