SCHEMBL21541871

SCHEMBL21541871

O=C(OC1CCN(c2ccc(Br)cc2)CC1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
CYP2C9 P11712 2/20 0.69
CYP2C19 P33261 2/20 0.69
POLB P06746 1/20 0.69
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
ALDH1A1 P00352 2/20 0.53
SCN1A P35498 3/20 0.52
SCN2A Q99250 3/20 0.52
SCN3A Q9NY46 3/20 0.52
CARM1 Q86X55 1/20 0.51
PRMT6 Q96LA8 1/20 0.51
PTPRF P10586 1/20 0.49
PTPN2 P17706 1/20 0.49
PTPN1 P18031 1/20 0.49
GAA P10253 1/20 0.48
CHRNA7 P36544 2/20 0.48
HTR3E A5X5Y0 1/20 0.48
HTR3B O95264 1/20 0.48
HTR3A P46098 1/20 0.48

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
SCHEMBL11976987 0.86 MAPT (0.69) MAPTCYP2C9CYP2C19POLBKMT2A
SCHEMBL13616264 0.86 MAPT (0.70) MAPTCYP2C9CYP2C19POLBKMT2A
SCHEMBL11977004 0.83 MAPT (0.65) MAPTCYP2C9CYP2C19POLBKMT2A
SCHEMBL8621135 0.82 MAPT (1.00) MAPTCYP2C9CYP2C19POLBKMT2A
SCHEMBL28316315 0.82 MAPT (0.48) MAPTCYP2C9CYP2C19POLBKMT2A
SCHEMBL8551089 0.80 CARM1 (0.57) MAPTCYP2C19KMT2AMEN1ALDH1A1
SCHEMBL28631027 0.80 HRH3 (0.47) MAPTCYP2C9CYP2C19POLBKMT2A
SCHEMBL578125 0.80 ALDH1A1 (0.46) MAPTCYP2C9CYP2C19POLBKMT2A
Hydrochloric Acid SCHEMBL8554706 0.79 KMT2A (0.58) MAPTCYP2C19KMT2AMEN1ALDH1A1
SCHEMBL16669518 0.79 NPY5R (0.45) MAPTCYP2C9CYP2C19POLBKMT2A

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-3567041-B1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF IMPACT THERAPEUTICS SHANGHAI INC (CN) 2023-12-27 EP disclosed
CN-110167941-B Substituted fused heteroaryl compounds as kinase inhibitors and uses thereof 上海瑛派药业有限公司 2023-04-04 CN disclosed
EP-3567041-A9 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics (Shanghai), Inc (CN) 2022-04-20 EP disclosed
US-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof IMPACT THERAPEUTICS, INC. (CN) 2020-12-29 US disclosed
EP-3567041-A1 SUBSTITUTED FUSED HETEROARYL COMPOUND SERVING AS A KINASE INHIBITOR, AND APPLICATIONS THEREOF Impact Therapeutics, Inc (CN) 2019-11-13 EP 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-10874670-B2 Substituted fused heteroaromatic compounds as kinase inhibitors and the use thereof CHEK1, CHEK2, CDK1 MAPT 3592/4885CYP2C9 2331/4885CYP2C19 1452/4885

“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.