SCHEMBL5599097

SCHEMBL5599097

Cc1cccc(/C=C/C(=O)/C=C/c2cccc(C)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.61
CYP2C9 P11712 3/20 0.61
HSD17B3 P37058 1/20 0.61
MAOA P21397 2/20 0.61
MAOB P27338 2/20 0.61
MAPT P10636 3/20 0.57
ALDH1A1 P00352 2/20 0.57
LMNA P02545 2/20 0.57
RECQL P46063 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
CYP2D6 P10635 2/20 0.57
PLIN1 O60240 1/20 0.57
F3 P13726 1/20 0.57
PLIN5 Q00G26 1/20 0.57
ABHD5 Q8WTS1 1/20 0.57
ALOX5 P09917 1/20 0.55
PTGS1 P23219 1/20 0.55
PTGS2 P35354 1/20 0.55
FBP1 P09467 1/20 0.53
MMP1 P03956 2/20 0.53

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
SCHEMBL5599099 1.00 CYP1A2 (0.61) CYP1A2CYP2C9HSD17B3MAOAMAOB
SCHEMBL10021687 0.91 MMP1 (0.65) CYP1A2CYP2C9HSD17B3MAOAMAOB
SCHEMBL29428457 0.91 MAOA (0.56) CYP1A2CYP2C9HSD17B3MAOAMAOB
SCHEMBL29426419 0.86 NPSR1 (0.62) CYP2C9MAOAMAOBMAPTALDH1A1
SCHEMBL79074 0.86 NPSR1 (0.62) CYP2C9MAOAMAOBMAPTALDH1A1
SCHEMBL8948080 0.86 TDP1 (0.62) MAOAMAOBMAPTALDH1A1LMNA
SCHEMBL6603490 0.86 TDP1 (0.62) MAOAMAOBMAPTALDH1A1LMNA
SCHEMBL79073 0.86 NPSR1 (0.62) CYP2C9MAOAMAOBMAPTALDH1A1
SCHEMBL9714866 0.86 NPSR1 (0.62) CYP2C9MAOAMAOBMAPTALDH1A1
SCHEMBL11999775 0.86 HTT (0.62) CYP1A2MAOAMAOBMAPTLMNA

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 60 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220152001-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2022-05-19 US disclosed
US-20200383958-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2020-12-10 US disclosed
US-10751330-B2 Human therapeutic agents ANKH LIFE SCIENCES LIMITED (IE) 2020-08-25 US disclosed
US-10744124-B2 Human therapeutic agents ANKH LIFE SCIENCES LIMITED (IE) 2020-08-18 US disclosed
US-20200147061-A1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LIMITED (IE) 2020-05-14 US disclosed
EP-3275465-B1 THERAPEUTIC COMPOSITIONS COMPRISING A COMBINATION OF A HARMINE AND ISOVANILLIN COMPONENT ANKH LIFE SCIENCES LTD (IE) 2020-05-06 EP disclosed
US-10576067-B2 Therapeutic compositions containing harmine and isovanillin components, and methods of use thereof ANKH LIFE SCIENCES LIMITED (IE) 2020-03-03 US disclosed
US-10471049-B2 Therapeutic compositions containing harmine and isovanillin components, and methods of use thereof ANKH LIFE SCIENCES LIMITED (IE) 2019-11-12 US disclosed
US-20190231756-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF ANKH LIFE SCIENCES LIMITED (IE) 2019-08-01 US disclosed
EP-3188721-B1 HUMAN THERAPEUTIC AGENTS ANKH LIFE SCIENCES LTD (IE) 2019-06-12 EP disclosed
US-20150011494-A1 THERAPEUTIC CURCUMIN DERIVATIVES STC.UNM 2015-01-08 US disclosed
US-20150011494-A1 THERAPEUTIC CURCUMIN DERIVATIVES STC.UNM 2015-01-08 US disclosed
US-8841326-B2 Therapeutic curcumin derivatives STC.UNM (US) 2014-09-23 US disclosed
US-8841326-B2 Therapeutic curcumin derivatives STC.UNM (US) 2014-09-23 US disclosed
US-8841326-B2 Therapeutic curcumin derivatives STC.UNM (US) 2014-09-23 US disclosed
US-20070060644-A1 Therapeutic curcumin derivatives STC.UNM 2007-03-15 US disclosed
US-20070060644-A1 Therapeutic curcumin derivatives STC.UNM 2007-03-15 US disclosed
US-20070060644-A1 Therapeutic curcumin derivatives STC.UNM 2007-03-15 US disclosed
US-20060276536-A1 Cancer treatment using curcumin derivatives STC.UNM 2006-12-07 US disclosed
US-RE29358-E ANTI-MALARIA AND ANTI-TUBERCULOSIS AGENTS AMERICAN CYANAMID COMPANY (US) 1977-08-16 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 (11 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-10744124-B2 Human therapeutic agents INMT, HNMT, HASPIN CYP1A2 2166/4885CYP2C9 3818/4885HSD17B3 2643/4885
US-20190231756-A1 THERAPEUTIC COMPOSITIONS CONTAINING HARMINE AND ISOVANILLIN COMPONENTS, AND METHODS OF USE THEREOF INMT, HNMT, COMT CYP1A2 1507/4885CYP2C9 2400/4885HSD17B3 1658/4885
US-20070060644-A1 Therapeutic curcumin derivatives FABP2, GLS2, FABP1 CYP1A2 2544/4885CYP2C9 3299/4885HSD17B3 1637/4885
US-10751330-B2 Human therapeutic agents INMT, HNMT, HASPIN CYP1A2 2166/4885CYP2C9 3818/4885HSD17B3 2643/4885
US-20150011494-A1 THERAPEUTIC CURCUMIN DERIVATIVES FABP2, GLS2, FABP1 CYP1A2 2544/4885CYP2C9 3299/4885HSD17B3 1637/4885
US-20220152001-A1 HUMAN THERAPEUTIC AGENTS INMT, HNMT, HASPIN CYP1A2 2166/4885CYP2C9 3818/4885HSD17B3 2643/4885
US-10471049-B2 Therapeutic compositions containing harmine and isovanillin components, and methods of use thereof INMT, HNMT, COMT CYP1A2 1507/4885CYP2C9 2400/4885HSD17B3 1658/4885
US-20200147061-A1 HUMAN THERAPEUTIC AGENTS INMT, HNMT, HASPIN CYP1A2 2166/4885CYP2C9 3818/4885HSD17B3 2643/4885
US-20200383958-A1 HUMAN THERAPEUTIC AGENTS INMT, HNMT, HASPIN CYP1A2 2166/4885CYP2C9 3818/4885HSD17B3 2643/4885
US-10576067-B2 Therapeutic compositions containing harmine and isovanillin components, and methods of use thereof INMT, HNMT, COMT CYP1A2 1507/4885CYP2C9 2400/4885HSD17B3 1658/4885
US-20060276536-A1 Cancer treatment using curcumin derivatives BRCA1, VHL, TP53 CYP1A2 760/4885CYP2C9 1867/4885HSD17B3 881/4885

“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.