SCHEMBL19844089

SCHEMBL19844089

C=CC1(C)CCC2C(O1)C(C)CC1C(C)(C)CCCC21C

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.34
▸ UGT2B7 P16662 2/20 0.32
▸ PTPN1 P18031 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.30
▸ CYP3A4 P08684 2/20 0.30
▸ CYP2C9 P11712 2/20 0.30
▸ TSHR P16473 2/20 0.30
▸ CYP2C19 P33261 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL19844090 0.76 CYP19A1 (0.39) CYP19A1UGT2B7PTPN1ALDH1A1CYP3A4
SCHEMBL18197939 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9
SCHEMBL16984766 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9
SCHEMBL3967644 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9
SCHEMBL16982582 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9
SCHEMBL16502918 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9
SCHEMBL20086741 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9
SCHEMBL3973400 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9
SCHEMBL16984745 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9
SCHEMBL29799288 0.66 ALDH1A1 (0.48) CYP19A1PTPN1ALDH1A1CYP3A4CYP2C9

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-20180037912-A1 Methods for Producing Diterpenes UNIVERSITY OF COPENHAGEN (DK) 2018-02-08 — — US disclosed
US-20180037912-A1 Methods for Producing Diterpenes UNIVERSITY OF COPENHAGEN (DK) 2018-02-08 — — 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 (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-20180037912-A1 Methods for Producing Diterpenes DHPS, COASY, FDPS CYP19A1 65/4885UGT2B7 115/4885PTPN1 4467/4885

“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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