SCHEMBL20655545

SCHEMBL20655545

COCCOc1cccc2c1ccn2C(C)C

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTR2C P28335 1/20 0.43
▸ MPO P05164 1/20 0.39
▸ HTR6 P50406 6/20 0.38
▸ PPARG P37231 1/20 0.36
▸ EZH2 Q15910 1/20 0.36
▸ HTR1B P28222 2/20 0.35
▸ VCP P55072 1/20 0.35
▸ F2RL3 Q96RI0 1/20 0.35
▸ GRM2 Q14416 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ NR2E1 Q9Y466 1/20 0.35
▸ BRD4 O60885 1/20 0.34

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
SCHEMBL20655543 0.83 GRM2 (0.42) HTR2CHTR6PPARGHTR1BGRM2
SCHEMBL19089433 0.79 HTR6 (0.40) HTR2CHTR6VCPPOLBL3MBTL1
SCHEMBL4324839 0.78 ROCK1 (0.50) HTR2CHTR6L3MBTL1BRD4
SCHEMBL18574221 0.73 HTR1B (0.47) HTR1BNR2E1
SCHEMBL25068973 0.71 TACR1 (0.39) HTR2CHTR6PPARG
SCHEMBL20655546 0.71 KDM4E (0.44) POLBBRD4
SCHEMBL13090965 0.69 HTR2C (0.53) HTR2CEZH2
SCHEMBL24481597 0.69 EZH2 (0.37) HTR2CEZH2
SCHEMBL18561728 0.69 SMN1; SMN2 (0.48) HTR1BL3MBTL1
SCHEMBL19910560 0.68 EZH2 (0.40) HTR2CHTR6EZH2HTR1BPOLB

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-10342796-B2 Acrylanilide derivative, preparation method, and applications thereof in pharmacy ANCUREALL PHARMACEUTICAL (SHANGHAI) CO., LTD. (CN) 2019-07-09 — — US disclosed
US-20190015413-A1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD, AND APPLICATIONS THEREOF IN PHARMACY ANCUREALL PHARMACEUTICAL (SHANGHAI) CO., LTD. (CN) 2019-01-17 — — 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-10342796-B2 Acrylanilide derivative, preparation method, and applications thereof in pharmacy EGFR, ABL1, CSNK1A1 HTR2C 2503/4885MPO 2495/4885HTR6 2326/4885
US-20190015413-A1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD, AND APPLICATIONS THEREOF IN PHARMACY EGFR, ABL1, CSNK1A1 HTR2C 2503/4885MPO 2495/4885HTR6 2326/4885

“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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