SCHEMBL1042907

SCHEMBL1042907

FC(F)(F)C([S])(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
ALDH1A1 P00352 2/20 0.52
PTPN1 P18031 2/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA5A P35218 1/20 0.39
CA9 Q16790 1/20 0.39
KCNN4 O15554 3/20 0.39
KIF11 P52732 1/20 0.39
MAPK1 P28482 1/20 0.35
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 2/20 0.33
PGK1 P00558 1/20 0.33
PGK2 P07205 1/20 0.33
PTPN5 P54829 1/20 0.32
TRPV6 Q9H1D0 1/20 0.32
CYP1A2 P05177 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
ALOX15 P16050 1/20 0.32
CES1 P23141 1/20 0.32

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
SCHEMBL6512580 0.78 TSHR (0.52) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL5609995 0.77 TSHR (0.58) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL11149724 0.74 KCNN4 (0.48) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL160204 0.71 TSHR (0.58) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL146900 0.71 TSHR (0.58) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL951559 0.71 TSHR (0.58) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL17288747 0.71 TSHR (0.58) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL11546152 0.71 TSHR (0.58) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL612731 0.71 ALDH1A1 (0.58) TSHRALDH1A1PTPN1CA1CA2
SCHEMBL8582066 0.71 TSHR (0.58) TSHRALDH1A1PTPN1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1026150-B1 (2-oxy substituted)-phenylalkanamide derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO LTD (JP) 2011-06-29 EP disclosed
EP-0903344-B1 Quinazolin-4-one derivatives, their preparation and their use as hair growth promoters or in external compositions for skin SHISEIDO CO LTD (JP) 2011-01-26 EP disclosed
US-6573297-B2 Applying an effective amount of (2-substituted oxyphenyl)alkanamide derivatives to the skin of a mammal for promoting hair growth SHISEIDO CO., LTD. (JP) 2003-06-03 US disclosed
EP-0911320-B1 1,2-Di-substituted benzenecarboxamide derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO LTD (JP) 2002-07-24 EP disclosed
EP-0940390-B1 [6-(Substituted-methyl)-3-cyclohexenyl]formamide derivative, hair growth promoter and external composition for skin SHISEIDO CO LTD (JP) 2002-07-17 EP disclosed
US-20020052498-A1 (2-substituted oxyphenyl)alkanamide derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO., LTD. (JP) 2002-05-02 US disclosed
EP-0933361-B1 1,2-Di-substituted piperidine derivatives as hair growth promoter SHISEIDO CO LTD (JP) 2002-03-27 EP disclosed
US-6339154-B1 THERAPY OF HAIR LOSS IN MAMMALS AND, IN PARTICULAR, IN HUMAN SHISEIDO CO, LTD. (JP) 2002-01-15 US disclosed
US-6204264-B1 Benzimidazole derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO., LTD. (JP) 2001-03-20 US disclosed
US-6174885-B1 IMPROVEMENT OR PREVENTION OF HAIR LOSS IN MAMMALS AND, IN PARTICULAR, IN HUMAN SHISEIDO CO., LTD. (JP) 2001-01-16 US disclosed
US-6114325-A 1,2-di-substituted benzene-carboxamide derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO., LTD. (JP) 2000-09-05 US disclosed
EP-1026150-A1 (2-oxy substituted)-phenylalkanamide derivative, hair growth promoter and external composition for skin using the same SHISEIDO COMPANY LIMITED (JP) 2000-08-09 EP disclosed
US-6057337-A USEFUL FOR CARE, IMPROVEMENT OR PREVENTION OF HAIR LOSS SHISEIDO CO., LTD. (JP) 2000-05-02 US disclosed
EP-0989123-A1 Benzimidazole derivative, hair growth promoter and external composition for skin using the same SHISEIDO COMPANY LIMITED (JP) 2000-03-29 EP disclosed
US-5972929-A Quinazolinone derivative, hair growth promoter and external composition for skin using the same SHISEIDO CO., LTD. (JP) 1999-10-26 US disclosed
EP-0940390-A1 6- (Substituted-methyl) -3- cyclohexenyl formamide derivative, hair growth promoter and external composition for skin SHISEIDO COMPANY LIMITED (JP) 1999-09-08 EP disclosed
EP-0933361-A1 1,2-Di-substituted piperidine derivatives as hair growth promoter SHISEIDO COMPANY LIMITED (JP) 1999-08-04 EP disclosed
EP-0911320-A2 1,2-Di-substituted benzenecarboxamide derivative, hair growth promoter and external composition for skin using the same SHISEIDO COMPANY LIMITED (JP) 1999-04-28 EP disclosed
EP-0903344-A1 Quinazolin-4-one derivatives, their preparation and their use as hair growth promoters or in external compositions for skin SHISEIDO COMPANY LIMITED (JP) 1999-03-24 EP 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-20020052498-A1 (2-substituted oxyphenyl)alkanamide derivative, hair growth promoter and external composition for skin using the same NR2E1, NCOR2, DECR2 TSHR 489/4885ALDH1A1 2015/4885PTPN1 2157/4885

“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.