SCHEMBL21787333

SCHEMBL21787333

CC(CO)Cc1c(F)cc(F)cc1Br

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.36
ADRB2 P07550 3/20 0.35
TRPA1 O75762 1/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
AKT1 P31749 1/20 0.32
TRPV3 Q8NET8 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
RIPK1 Q13546 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL21777383 1.00 HPGD (0.36) HPGDADRB2TRPA1KMT2AMAPT
SCHEMBL3036892 0.87 TRPA1 (0.38) TRPA1TRPV3RIPK1
SCHEMBL21777877 0.82 ADRB2 (0.33) HPGDADRB2AKT1RIPK1
SCHEMBL23835482 0.77 MAPT (0.38) HPGDKMT2AMAPTRIPK1ALDH1A1
SCHEMBL29921242 0.77 MAPT (0.38) HPGDKMT2AMAPTRIPK1ALDH1A1
SCHEMBL4203473 0.75 DPP4 (0.41) ADRB2TRPA1ALOX15ALOX12
SCHEMBL13236485 0.72 RIPK1 (0.35) HPGDKMT2AMAPTRIPK1ALDH1A1
SCHEMBL14457240 0.71 TRPA1 (0.42) TRPA1TRPV3
SCHEMBL29920980 0.70 MAPT (0.39) HPGDKMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL23834830 0.70 MAPT (0.39) HPGDKMT2AMAPTALDH1A1SMN1; SMN2

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
US-20230219949-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC, INC. 2023-07-13 US disclosed
US-20230219949-A1 INHIBITORS OF (ALPHA-V)(BETA-6) INTEGRIN MORPHIC THERAPEUTIC, INC. 2023-07-13 US 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 HPGD 3107/4885ADRB2 377/4885TRPA1 4065/4885

“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.