SCHEMBL10192292

SCHEMBL10192292

C=C1C(=O)OC2CCCCC12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.41
▸ TDP1 Q9NUW8 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ STAT3 P40763 1/20 0.40
▸ NLRP3 Q96P20 1/20 0.40
▸ PTGS2 P35354 2/20 0.36
▸ TAS2R46 P59540 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TERT O14746 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ XBP1 P17861 1/20 0.35

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
SCHEMBL24299728 1.00 CYP19A1 (0.41) CYP19A1TDP1CYP3A4CYP2D6CYP2C9
SCHEMBL17147749 0.98 CYP19A1 (0.40) CYP19A1TDP1CYP3A4CYP2D6CYP2C9
SCHEMBL18981114 0.98 CYP19A1 (0.40) CYP19A1TDP1CYP3A4CYP2D6CYP2C9
SCHEMBL18981060 0.98 CYP19A1 (0.40) CYP19A1TDP1CYP3A4CYP2D6CYP2C9
SCHEMBL8394084 0.96 CYP19A1 (0.44) CYP19A1TDP1CYP3A4CYP2D6CYP2C9
SCHEMBL17147745 0.77 CYP19A1 (0.44) CYP19A1TDP1CYP3A4CYP2D6CYP2C9
SCHEMBL12620335 0.76 NLRP3 (0.42) CYP19A1TDP1CYP3A4CYP2D6CYP2C9
SCHEMBL10933310 0.75 CA1 (0.43) CYP19A1TDP1CYP3A4CYP2D6CYP2C9
SCHEMBL11291174 0.73 PRSS1 (0.33) CYP19A1
SCHEMBL9240777 0.72 MAPT (0.43) TDP1CYP3A4CYP2D6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170174802-A1 COPOLYMER AND MOLDED ARTICLE KURARAY CO., LTD. (JP) 2017-06-22 — — US claimed
US-4154962-A Synthesis of hydratropic acid and some of its alkyl derivatives AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 1979-05-15 — — US claimed
US-20170174802-A1 COPOLYMER AND MOLDED ARTICLE KURARAY CO., LTD. (JP) 2017-06-22 — — US disclosed
US-20170174802-A1 COPOLYMER AND MOLDED ARTICLE KURARAY CO., LTD. (JP) 2017-06-22 — — US disclosed
US-20170174802-A1 COPOLYMER AND MOLDED ARTICLE KURARAY CO., LTD. (JP) 2017-06-22 — — US disclosed
US-8093409-B2 Method for producing cyclic unsaturated compound NIPPON SHOKUBAI CO., LTD. (JP) 2012-01-10 — — US disclosed
US-8093409-B2 Method for producing cyclic unsaturated compound NIPPON SHOKUBAI CO., LTD. (JP) 2012-01-10 — — US disclosed
US-20090299009-A1 METHOD FOR PRODUCING CYCLIC UNSATURATED COMPOUND NIPPON SHOKUBAI CO., LTD. (JP) 2009-12-03 — — US disclosed
US-20090299009-A1 METHOD FOR PRODUCING CYCLIC UNSATURATED COMPOUND NIPPON SHOKUBAI CO., LTD. (JP) 2009-12-03 — — US disclosed
WO-2008023823-A1 METHOD FOR PRODUCING CYCLIC UNSATURATED COMPOUND NIPPON SHOKUBAI CO., LTD. (JP) 2008-02-28 — — WO disclosed
US-4154962-A Synthesis of hydratropic acid and some of its alkyl derivatives AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 1979-05-15 — — 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-20090299009-A1 METHOD FOR PRODUCING CYCLIC UNSATURATED COMPOUND FASN, SQLE, ALOX5 CYP19A1 42/4885TDP1 4807/4885CYP3A4 275/4885

“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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