SCHEMBL30226503

SCHEMBL30226503

O=C(NCC1CC1)c1ccc(F)nc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.57
RCOR1 Q9UKL0 1/20 0.57
MAPK14 Q16539 4/20 0.53
CYP2C9 P11712 2/20 0.53
MAPK11 Q15759 1/20 0.53
EPHX2 P34913 1/20 0.52
HDAC6 Q9UBN7 3/20 0.51
GABRA5 P31644 4/20 0.50
MLYCD O95822 1/20 0.49
HDAC4 P56524 1/20 0.47
NAMPT P43490 1/20 0.46

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
SCHEMBL13450627 0.82 HDAC6 (0.57) MAPK14CYP2C9MAPK11EPHX2HDAC6
SCHEMBL5420230 0.82 GABRA1 (0.60) MAPK14CYP2C9MAPK11HDAC6GABRA5
SCHEMBL3409240 0.82 L3MBTL1 (0.57) MAPK14CYP2C9MAPK11HDAC6GABRA5
SCHEMBL29926296 0.79 HDAC6 (0.59) MAPK14CYP2C9HDAC6MLYCDHDAC4
SCHEMBL4007129 0.78 L3MBTL1 (0.53) MAPK14CYP2C9MAPK11HDAC6GABRA5
SCHEMBL14160465 0.78 EPHX2 (0.46) KDM1ARCOR1MAPK14CYP2C9MAPK11
SCHEMBL2863458 0.78 TAS1R3 (0.53) MAPK14HDAC6HDAC4
SCHEMBL1542860 0.77 GABRA5 (0.59) MAPK14CYP2C9MAPK11GABRA5
SCHEMBL4648730 0.77 HDAC6 (0.58) HDAC6MLYCDNAMPT
SCHEMBL3404706 0.77 HDAC6 (0.55) HDAC6MLYCD

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-12497351-B2 3-N-cyclopropylmethyl-2-fluorobenzamide compound, preparation method therefor and use thereof CAC NANTONG CHEMICAL CO., LTD (CN) 2025-12-16 US disclosed
US-20230020373-A1 3-N-CYCLOPROPYLMETHYL-2-FLUOROBENZAMIDE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF CAC NANTONG CHEMICAL CO., LTD (CN) 2023-01-19 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-12497351-B2 3-N-cyclopropylmethyl-2-fluorobenzamide compound, preparation method therefor and use thereof CYP51A1, DDT, CYP4F11 KDM1A 932/4885RCOR1 4050/4885MAPK14 1062/4885
US-20230020373-A1 3-N-CYCLOPROPYLMETHYL-2-FLUOROBENZAMIDE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF CYP51A1, DDT, CYP4F11 KDM1A 932/4885RCOR1 4050/4885MAPK14 1062/4885

“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.