SCHEMBL7107767

SCHEMBL7107767

CNC(=O)N1CCCCC1C

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
HPGD P15428 5/20 0.53
GAA P10253 2/20 0.53
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.47
EPHX2 P34913 1/20 0.47
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
NAMPT P43490 1/20 0.41
KMT2A Q03164 1/20 0.40

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
SCHEMBL20203666 1.00 ALDH1A1 (0.57) ALDH1A1HPGDGAATSHRHSD17B10
SCHEMBL10202307 0.94 ALDH1A1 (0.50) ALDH1A1HPGDGAATSHRHSD17B10
SCHEMBL14930583 0.94 ALDH1A1 (0.50) ALDH1A1HPGDGAATSHRHSD17B10
SCHEMBL7478058 0.94 ALDH1A1 (0.50) ALDH1A1HPGDGAATSHRHSD17B10
SCHEMBL16077992 0.82 ALDH1A1 (0.56) ALDH1A1HPGDGAATSHRHSD17B10
SCHEMBL22047940 0.82 ALDH1A1 (0.55) ALDH1A1HPGDGAATSHRHSD17B10
SCHEMBL13873135 0.79 ALDH1A1 (0.53) ALDH1A1HPGDGAATSHRHSD17B10
SCHEMBL14635889 0.79 ALDH1A1 (0.53) ALDH1A1HPGDGAATSHRHSD17B10
SCHEMBL4028484 0.79 HPGD (0.60) ALDH1A1HPGDGAATSHRSMN1; SMN2
SCHEMBL14439211 0.77 HPGD (0.58) ALDH1A1HPGDGAASMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030139427-A1 Bicyclic pyrimidinyl derivatives and methods of use thereof OSI PHARMACEUTICALS INC. 2003-07-24 US claimed
EP-3356345-B1 HETEROARYL DERIVATIVES AS SEPIAPTERIN REDUCTASE INHIBITORS MAX PLANCK GESELLSCHAFT (DE) 2023-11-08 EP disclosed
US-10779540-B2 Benzamide compounds and their use as herbicides BASF SE (DE) 2020-09-22 US disclosed
EP-3390372-B1 BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2020-06-03 EP disclosed
WO-2017102275-A1 BENZAMIDE COMPOUNDS AND THEIR USE AS HERBICIDES BASF SE (DE) 2017-06-22 WO disclosed
US-20030139427-A1 Bicyclic pyrimidinyl derivatives and methods of use thereof OSI PHARMACEUTICALS INC. 2003-07-24 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-10779540-B2 Benzamide compounds and their use as herbicides DDT, DNPH1, BBOX1 ALDH1A1 74/4885HPGD 907/4885GAA 421/4885
US-20030139427-A1 Bicyclic pyrimidinyl derivatives and methods of use thereof ADORA2A, ADORA3, ADORA1 ALDH1A1 417/4885HPGD 2007/4885GAA 1734/4885

“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.