SCHEMBL19584584

SCHEMBL19584584

CCCC#Cc1nc(C(=O)OCC)ccc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.48
▸ CTSL P07711 1/20 0.41
▸ CTSB P07858 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ TRPM8 Q7Z2W7 1/20 0.39
▸ GABRA2 P47869 2/20 0.38
▸ GABRB2 P47870 2/20 0.38
▸ ALDH1A1 P00352 3/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ GRM5 P41594 2/20 0.36
▸ HTR7 P34969 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ POLB P06746 1/20 0.35

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
SCHEMBL17417552 0.88 PTGER4 (0.37) CYP1A2CTSLCTSBMAPTSMN1; SMN2
SCHEMBL19584784 0.85 CYP1A2 (0.51) CYP1A2MAPTGABRA2GABRB2ALDH1A1
SCHEMBL17417363 0.77 PTGER4 (0.39) CYP1A2MAPTSMN1; SMN2TP53NPC1
SCHEMBL17429955 0.75 TLR8 (0.35) GRM5
SCHEMBL19584461 0.73 CYP1A2 (0.57) CYP1A2MAPTGABRA2GABRB2ALDH1A1
SCHEMBL14770747 0.68 CTSL (0.40) CYP1A2CTSLCTSBMAPTGABRA2
SCHEMBL6708132 0.67 CA1 (0.54) CYP1A2MAPTALDH1A1SMN1; SMN2MEN1
SCHEMBL3328822 0.67 CYP1A2 (0.49) CYP1A2MAPTGABRA2GABRB2ALDH1A1
SCHEMBL1695597 0.67 CYP1A2 (0.49) CYP1A2MAPTGABRA2ALDH1A1SMN1; SMN2
SCHEMBL16415870 0.66 CYP1A2 (0.77) CYP1A2MAPTTRPM8GABRA2GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3455212-B1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 HEPTARES THERAPEUTICS LTD (GB) 2022-02-09 — — EP disclosed
US-10995072-B2 Inhibitors of protease-activated receptor-2 HEPTARES THERAPEUTICS LIMITED (GB) 2021-05-04 — — US disclosed
US-20200140392-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 NXERA PHARMA UK LIMITED (GB) 2020-05-07 — — US disclosed
US-10550089-B2 Inhibitors of protease-activated receptor-2 HEPTARES THERAPEUTICS LIMITED (GB) 2020-02-04 — — US disclosed
US-20190144394-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 HEPTARES THERAPEUTICS LIMITED (GB) 2019-05-16 — — US disclosed
EP-3455212-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 Heptares Therapeutics Limited (GB) 2019-03-20 — — EP disclosed
WO-2017194716-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 ASTRAZENECA AB (SE) 2017-11-16 — — 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 (4 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-10550089-B2 Inhibitors of protease-activated receptor-2 F2RL1, F2R, F2RL3 CYP1A2 474/4885CTSL 73/4885CTSB 35/4885
US-20190144394-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 F2RL1, F2R, F2RL3 CYP1A2 474/4885CTSL 73/4885CTSB 35/4885
US-10995072-B2 Inhibitors of protease-activated receptor-2 F2RL1, F2R, F2RL3 CYP1A2 963/4885CTSL 66/4885CTSB 30/4885
US-20200140392-A1 INHIBITORS OF PROTEASE-ACTIVATED RECEPTOR-2 F2RL1, F2R, F2RL3 CYP1A2 963/4885CTSL 66/4885CTSB 30/4885

“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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